1-[4-[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)pyrrol-3-yl]carbonylpiperazin-1-yl]hexan-1-one

Systemtic Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)pyrrol-3-yl]carbonylpiperazin-1-yl]hexan-1-one Openeye Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(m-tolyl)pyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one CAS Name: 1-[4-[[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-1-hexanone IUPAC Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(3-methylphenyl)pyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one Traditional Name: 1-[4-[5-(4-chlorophenyl)-2-methyl-1-(m-tolyl)pyrrole-3-carbonyl]piperazino]hexan-1-one Formula: C29H34ClN3O2 MolecularWeight: 492.05216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=CC(=C4)C)C

Isomeric SMILES

CCCCCC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=CC(=C4)C)C

InChI

InChI=1S/C29H34ClN3O2/c1-4-5-6-10-28(34)31-15-17-32(18-16-31)29(35)26-20-27(23-11-13-24(30)14-12-23)33(22(26)3)25-9-7-8-21(2)19-25/h7-9,11-14,19-20H,4-6,10,15-18H2,1-3H3