1-[4-[4-[2,5-dimethyl-1-(2-methylphenyl)pyrrol-3-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[2,5-dimethyl-1-(2-methylphenyl)pyrrol-3-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[2,5-dimethyl-1-(o-tolyl)pyrrole-3-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[2,5-dimethyl-1-(2-methylphenyl)-3-pyrrolyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[2,5-dimethyl-1-(2-methylphenyl)pyrrole-3-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[2,5-dimethyl-1-(o-tolyl)pyrrole-3-carbonyl]piperazino]phenyl]ethanone Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=C2C)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=C2C)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C)C

InChI

InChI=1S/C26H29N3O2/c1-18-7-5-6-8-25(18)29-19(2)17-24(20(29)3)26(31)28-15-13-27(14-16-28)23-11-9-22(10-12-23)21(4)30/h5-12,17H,13-16H2,1-4H3