7a-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2,2-dimethyl-propyl]-3aH-isoindole-1,3-dione

Systemtic Name: 7a-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2,2-dimethyl-propyl]-3aH-isoindole-1,3-dione Openeye Name: 7a-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2,2-dimethyl-propyl]-3aH-isoindole-1,3-dione CAS Name: 7a-[3-[4-(2-methoxyphenyl)-1-piperazinyl]-2,2-dimethylpropyl]-3aH-isoindole-1,3-dione IUPAC Name: 7a-[3-[4-(2-methoxyphenyl)piperazin-1-yl]-2,2-dimethylpropyl]-3aH-isoindole-1,3-dione Traditional Name: 7a-[3-[4-(2-methoxyphenyl)piperazino]-2,2-dimethyl-propyl]-3aH-isoindole-1,3-quinone Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC12C=CC=CC1C(=O)NC2=O)CN3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC(C)(CC12C=CC=CC1C(=O)NC2=O)CN3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C24H31N3O3/c1-23(2,16-24-11-7-6-8-18(24)21(28)25-22(24)29)17-26-12-14-27(15-13-26)19-9-4-5-10-20(19)30-3/h4-11,18H,12-17H2,1-3H3,(H,25,28,29)