1-(diphenylamino)-6-methyl-2-(1-oxidanyl-2-phenylmethoxy-ethyl)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 1-(diphenylamino)-6-methyl-2-(1-oxidanyl-2-phenylmethoxy-ethyl)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 2-(2-benzyloxy-1-hydroxy-ethyl)-6-methyl-1-(N-phenylanilino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 2-(1-hydroxy-2-phenylmethoxyethyl)-6-methyl-1-(N-phenylanilino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 2-(1-hydroxy-2-phenylmethoxyethyl)-6-methyl-1-(N-phenylanilino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 2-(2-benzoxy-1-hydroxy-ethyl)-6-methyl-1-(N-phenylanilino)-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C29H29N3O4 MolecularWeight: 483.55826

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2C=CC(N(C2C1=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C(COCC5=CC=CC=C5)O

Isomeric SMILES

CN1C(=O)C2C=CC(N(C2C1=O)N(C3=CC=CC=C3)C4=CC=CC=C4)C(COCC5=CC=CC=C5)O

InChI

InChI=1S/C29H29N3O4/c1-30-28(34)24-17-18-25(26(33)20-36-19-21-11-5-2-6-12-21)32(27(24)29(30)35)31(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-18,24-27,33H,19-20H2,1H3