ethyl 2-[(1S,7aS)-1-oxidanyl-3-oxidanylidene-1-phenyl-2,7a-dihydropyrrolo[3,4-c]pyridin-5-yl]ethanoate

Systemtic Name: ethyl 2-[(1S,7aS)-1-oxidanyl-3-oxidanylidene-1-phenyl-2,7a-dihydropyrrolo[3,4-c]pyridin-5-yl]ethanoate Openeye Name: ethyl 2-[(1S,7aS)-1-hydroxy-3-oxo-1-phenyl-2,7a-dihydropyrrolo[3,4-c]pyridin-5-yl]acetate CAS Name: 2-[(1S,7aS)-1-hydroxy-3-oxo-1-phenyl-2,7a-dihydropyrrolo[3,4-c]pyridin-5-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(1S,7aS)-1-hydroxy-3-oxo-1-phenyl-2,7a-dihydropyrrolo[3,4-c]pyridin-5-yl]acetate Traditional Name: 2-[(1S,7aS)-1-hydroxy-3-keto-1-phenyl-2,7a-dihydropyrrolo[3,4-c]pyridin-5-yl]acetic acid ethyl ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=CC2C(=C1)C(=O)NC2(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)CN1C=C[C@H]2C(=C1)C(=O)N[C@]2(C3=CC=CC=C3)O

InChI

InChI=1S/C17H18N2O4/c1-2-23-15(20)11-19-9-8-14-13(10-19)16(21)18-17(14,22)12-6-4-3-5-7-12/h3-10,14,22H,2,11H2,1H3,(H,18,21)/t14-,17+/m0/s1