Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 5 results

Search term: AGBMABXDVFVTEF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2046807

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H21FN4O4/c21-15-3-1-2-4-17(15)24-11-9-23(10-12-24)8-7-18-20(26)22-16-6-5-14(25(27)28)13-19(16)29-18/h1-6,13,18H,7-12H2,(H,22,26)
C20H21FN4O4400.4035432161600
5432515

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H21FN4O4/c21-15-3-1-2-4-17(15)24-11-9-23(10-12-24)8-7-18-20(26)22-16-6-5-14(25(27)28)13-19(16)29-18/h1-6,13,18H,7-12H2,(H,22,26)/t18-/m1/s1
C20H21FN4O4400.40352100
5432517

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H21FN4O4/c21-15-3-1-2-4-17(15)24-11-9-23(10-12-24)8-7-18-20(26)22-16-6-5-14(25(27)28)13-19(16)29-18/h1-6,13,18H,7-12H2,(H,22,26)/t18-/m0/s1
C20H21FN4O4400.40352100
5432516

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H21FN4O4/c21-15-3-1-2-4-17(15)24-11-9-23(10-12-24)8-7-18-20(26)22-16-6-5-14(25(27)28)13-19(16)29-18/h1-6,13,18H,7-12H2,(H,22,26)/p+1/t18-/m0/s1
C20H22FN4O4401.41091100
5432514

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H21FN4O4/c21-15-3-1-2-4-17(15)24-11-9-23(10-12-24)8-7-18-20(26)22-16-6-5-14(25(27)28)13-19(16)29-18/h1-6,13,18H,7-12H2,(H,22,26)/p+1/t18-/m1/s1
C20H22FN4O4401.41091100

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