2-(2-ethyl-1-oxidanyl-butyl)-6-phenyl-1-phenylazanyl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 2-(2-ethyl-1-oxidanyl-butyl)-6-phenyl-1-phenylazanyl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 1-anilino-2-(2-ethyl-1-hydroxy-butyl)-6-phenyl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 1-anilino-2-(2-ethyl-1-hydroxybutyl)-6-phenyl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 1-anilino-2-(2-ethyl-1-hydroxybutyl)-6-phenyl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 1-anilino-2-(2-ethyl-1-hydroxy-butyl)-6-phenyl-4a,7a-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C25H29N3O3 MolecularWeight: 419.51606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C1C=CC2C(N1NC3=CC=CC=C3)C(=O)N(C2=O)C4=CC=CC=C4)O

Isomeric SMILES

CCC(CC)C(C1C=CC2C(N1NC3=CC=CC=C3)C(=O)N(C2=O)C4=CC=CC=C4)O

InChI

InChI=1S/C25H29N3O3/c1-3-17(4-2)23(29)21-16-15-20-22(28(21)26-18-11-7-5-8-12-18)25(31)27(24(20)30)19-13-9-6-10-14-19/h5-17,20-23,26,29H,3-4H2,1-2H3