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

Systemtic Name: 2-[1-[4-(diphenylmethyl)piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-(4-benzhydrylpiperazine-1-carbonyl)-2-methyl-propyl]isoindoline-1,3-dione CAS Name: 2-[1-[4-(diphenylmethyl)-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-(4-benzhydrylpiperazin-1-yl)-3-methyl-1-oxobutan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-(4-benzhydrylpiperazine-1-carbonyl)-2-methyl-propyl]isoindoline-1,3-quinone Formula: C30H31N3O3 MolecularWeight: 481.58544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C30H31N3O3/c1-21(2)26(33-28(34)24-15-9-10-16-25(24)29(33)35)30(36)32-19-17-31(18-20-32)27(22-11-5-3-6-12-22)23-13-7-4-8-14-23/h3-16,21,26-27H,17-20H2,1-2H3