4-[4-[4-(diphenylmethyl)-2-methyl-piperazin-1-yl]butyl]isoindole-1,3-dione

Systemtic Name: 4-[4-[4-(diphenylmethyl)-2-methyl-piperazin-1-yl]butyl]isoindole-1,3-dione Openeye Name: 4-[4-(4-benzhydryl-2-methyl-piperazin-1-yl)butyl]isoindoline-1,3-dione CAS Name: 4-[4-[4-(diphenylmethyl)-2-methyl-1-piperazinyl]butyl]isoindole-1,3-dione IUPAC Name: 4-[4-(4-benzhydryl-2-methylpiperazin-1-yl)butyl]isoindole-1,3-dione Traditional Name: 4-[4-(4-benzhydryl-2-methyl-piperazino)butyl]isoindoline-1,3-quinone Formula: C30H33N3O2 MolecularWeight: 467.60192

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CCCCC2=CC=CC3=C2C(=O)NC3=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1CN(CCN1CCCCC2=CC=CC3=C2C(=O)NC3=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H33N3O2/c1-22-21-33(28(24-12-4-2-5-13-24)25-14-6-3-7-15-25)20-19-32(22)18-9-8-11-23-16-10-17-26-27(23)30(35)31-29(26)34/h2-7,10,12-17,22,28H,8-9,11,18-21H2,1H3,(H,31,34,35)