ethyl 4-[5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)pyrrol-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)pyrrol-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[5-(4-chlorophenyl)-2-methyl-1-(o-tolyl)pyrrole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)-3-pyrrolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(4-chlorophenyl)-2-methyl-1-(2-methylphenyl)pyrrole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-(4-chlorophenyl)-2-methyl-1-(o-tolyl)pyrrole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H28ClN3O3 MolecularWeight: 465.97182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4C)C

InChI

InChI=1S/C26H28ClN3O3/c1-4-33-26(32)29-15-13-28(14-16-29)25(31)22-17-24(20-9-11-21(27)12-10-20)30(19(22)3)23-8-6-5-7-18(23)2/h5-12,17H,4,13-16H2,1-3H3