2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(2-naphthalen-2-ylethanoyl)piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(2-naphthalen-2-ylethanoyl)piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-[2-(2-naphthyl)acetyl]piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-[2-(2-naphthalenyl)-1-oxoethyl]-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-[(2,3-dimethoxyphenyl)methyl]-4-[4-(2-naphthalen-2-ylacetyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 4-[4-[2-(2-naphthyl)acetyl]piperazino]-2-o-veratryl-isoindoline-1,3-quinone Formula: C33H31N3O5 MolecularWeight: 549.61634

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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)CC5=CC6=CC=CC=C6C=C5

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2C(=O)C3=C(C2=O)C(=CC=C3)N4CCN(CC4)C(=O)CC5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C33H31N3O5/c1-40-28-12-5-9-25(31(28)41-2)21-36-32(38)26-10-6-11-27(30(26)33(36)39)34-15-17-35(18-16-34)29(37)20-22-13-14-23-7-3-4-8-24(23)19-22/h3-14,19H,15-18,20-21H2,1-2H3