4-(4-propan-2-ylpiperazin-1-yl)-2-[(3,4,5-trimethoxyphenyl)methyl]isoindole-1,3-dione

Systemtic Name: 4-(4-propan-2-ylpiperazin-1-yl)-2-[(3,4,5-trimethoxyphenyl)methyl]isoindole-1,3-dione Openeye Name: 4-(4-isopropylpiperazin-1-yl)-2-[(3,4,5-trimethoxyphenyl)methyl]isoindoline-1,3-dione CAS Name: 4-(4-propan-2-yl-1-piperazinyl)-2-[(3,4,5-trimethoxyphenyl)methyl]isoindole-1,3-dione IUPAC Name: 4-(4-propan-2-ylpiperazin-1-yl)-2-[(3,4,5-trimethoxyphenyl)methyl]isoindole-1,3-dione Traditional Name: 4-(4-isopropylpiperazino)-2-(3,4,5-trimethoxybenzyl)isoindoline-1,3-quinone Formula: C25H31N3O5 MolecularWeight: 453.53074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC(C)N1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C25H31N3O5/c1-16(2)26-9-11-27(12-10-26)19-8-6-7-18-22(19)25(30)28(24(18)29)15-17-13-20(31-3)23(33-5)21(14-17)32-4/h6-8,13-14,16H,9-12,15H2,1-5H3