2-(3-methoxypropyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-(3-methoxypropyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-(3-methoxypropyl)-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-(3-methoxypropyl)-5-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]isoindole-1,3-dione IUPAC Name: 2-(3-methoxypropyl)-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 2-(3-methoxypropyl)-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C23H24N4O6 MolecularWeight: 452.45986

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O6/c1-33-14-2-9-26-22(29)19-8-3-16(15-20(19)23(26)30)21(28)25-12-10-24(11-13-25)17-4-6-18(7-5-17)27(31)32/h3-8,15H,2,9-14H2,1H3