6-methyl-2-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propyl]-4-piperidin-1-yl-pyrrolo[3,4-c]pyridine-1,3-dione

Systemtic Name: 6-methyl-2-[2-oxidanyl-3-(4-phenylpiperazin-1-yl)propyl]-4-piperidin-1-yl-pyrrolo[3,4-c]pyridine-1,3-dione Openeye Name: 2-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propyl]-6-methyl-4-(1-piperidyl)pyrrolo[3,4-c]pyridine-1,3-dione CAS Name: 2-[2-hydroxy-3-(4-phenyl-1-piperazinyl)propyl]-6-methyl-4-(1-piperidinyl)pyrrolo[3,4-c]pyridine-1,3-dione IUPAC Name: 2-[2-hydroxy-3-(4-phenylpiperazin-1-yl)propyl]-6-methyl-4-piperidin-1-ylpyrrolo[3,4-c]pyridine-1,3-dione Traditional Name: 2-[2-hydroxy-3-(4-phenylpiperazino)propyl]-6-methyl-4-piperidino-pyrrolo[3,4-c]pyridine-1,3-quinone Formula: C26H33N5O3 MolecularWeight: 463.57192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=C1)C(=O)N(C2=O)CC(CN3CCN(CC3)C4=CC=CC=C4)O)N5CCCCC5

Isomeric SMILES

CC1=NC(=C2C(=C1)C(=O)N(C2=O)CC(CN3CCN(CC3)C4=CC=CC=C4)O)N5CCCCC5

InChI

InChI=1S/C26H33N5O3/c1-19-16-22-23(24(27-19)30-10-6-3-7-11-30)26(34)31(25(22)33)18-21(32)17-28-12-14-29(15-13-28)20-8-4-2-5-9-20/h2,4-5,8-9,16,21,32H,3,6-7,10-15,17-18H2,1H3