6-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 6-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 6-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 6-[4-oxo-4-(4-phenyl-1-piperazinyl)butyl]pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 6-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 6-[4-keto-4-(4-phenylpiperazino)butyl]pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=C(C3=O)N=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=C(C3=O)N=CC=C4

InChI

InChI=1S/C21H22N4O3/c26-18(24-14-12-23(13-15-24)16-6-2-1-3-7-16)9-5-11-25-20(27)17-8-4-10-22-19(17)21(25)28/h1-4,6-8,10H,5,9,11-15H2