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

Systemtic Name: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperazin-1-yl]hexan-1-one Openeye Name: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one CAS Name: 1-[4-[[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-1-hexanone IUPAC Name: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazin-1-yl]hexan-1-one Traditional Name: 1-[4-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazino]hexan-1-one Formula: C29H34ClN3O3 MolecularWeight: 508.05156

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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=C(C=C4)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C29H34ClN3O3/c1-4-5-6-7-28(34)31-16-18-32(19-17-31)29(35)26-20-27(22-8-10-23(30)11-9-22)33(21(26)2)24-12-14-25(36-3)15-13-24/h8-15,20H,4-7,16-19H2,1-3H3