2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(4-phenylphenyl)carbonylpiperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(4-phenylphenyl)carbonylpiperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(4-phenylbenzoyl)piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-[oxo-(4-phenylphenyl)methyl]-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(4-phenylbenzoyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 2-o-veratryl-4-[4-(4-phenylbenzoyl)piperazino]isoindoline-1,3-quinone Formula: C34H31N3O5 MolecularWeight: 561.62704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)C(=O)C5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)C(=O)C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H31N3O5/c1-41-29-13-6-10-26(31(29)42-2)22-37-33(39)27-11-7-12-28(30(27)34(37)40)35-18-20-36(21-19-35)32(38)25-16-14-24(15-17-25)23-8-4-3-5-9-23/h3-17H,18-22H2,1-2H3