3,4-dimethyl-1-[4-[4-(4-phenylphenyl)piperazin-1-yl]but-2-ynyl]pyrrolidine-2,5-dione

Systemtic Name: 3,4-dimethyl-1-[4-[4-(4-phenylphenyl)piperazin-1-yl]but-2-ynyl]pyrrolidine-2,5-dione Openeye Name: 3,4-dimethyl-1-[4-[4-(4-phenylphenyl)piperazin-1-yl]but-2-ynyl]pyrrolidine-2,5-dione CAS Name: 3,4-dimethyl-1-[4-[4-(4-phenylphenyl)-1-piperazinyl]but-2-ynyl]pyrrolidine-2,5-dione IUPAC Name: 3,4-dimethyl-1-[4-[4-(4-phenylphenyl)piperazin-1-yl]but-2-ynyl]pyrrolidine-2,5-dione Traditional Name: 3,4-dimethyl-1-[4-[4-(4-phenylphenyl)piperazino]but-2-ynyl]pyrrolidine-2,5-quinone Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N(C1=O)CC#CCN2CCN(CC2)C3=CC=C(C=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1C(C(=O)N(C1=O)CC#CCN2CCN(CC2)C3=CC=C(C=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H29N3O2/c1-20-21(2)26(31)29(25(20)30)15-7-6-14-27-16-18-28(19-17-27)24-12-10-23(11-13-24)22-8-4-3-5-9-22/h3-5,8-13,20-21H,14-19H2,1-2H3