(3aS,9bS)-9b-oxidanyl-2-(phenylmethyl)-3a,5-dihydro-3H-pyrrolo[3,4-c]quinoline-1,4-dione

Systemtic Name: (3aS,9bS)-9b-oxidanyl-2-(phenylmethyl)-3a,5-dihydro-3H-pyrrolo[3,4-c]quinoline-1,4-dione Openeye Name: (3aS,9bS)-2-benzyl-9b-hydroxy-3a,5-dihydro-3H-pyrrolo[3,4-c]quinoline-1,4-dione CAS Name: (3aS,9bS)-9b-hydroxy-2-(phenylmethyl)-3a,5-dihydro-3H-pyrrolo[3,4-c]quinoline-1,4-dione IUPAC Name: (3aS,9bS)-2-benzyl-9b-hydroxy-3a,5-dihydro-3H-pyrrolo[3,4-c]quinoline-1,4-dione Traditional Name: (3aS,9bS)-2-benzyl-9b-hydroxy-3a,5-dihydro-3H-pyrrolo[3,4-c]quinoline-1,4-quinone Formula: C18H16N2O3 MolecularWeight: 308.33124

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(=O)NC3=CC=CC=C3C2(C(=O)N1CC4=CC=CC=C4)O

Isomeric SMILES

C1[C@@H]2C(=O)NC3=CC=CC=C3[C@@]2(C(=O)N1CC4=CC=CC=C4)O

InChI

InChI=1S/C18H16N2O3/c21-16-14-11-20(10-12-6-2-1-3-7-12)17(22)18(14,23)13-8-4-5-9-15(13)19-16/h1-9,14,23H,10-11H2,(H,19,21)/t14-,18-/m1/s1