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

Systemtic Name: ethyl 4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(2-chlorophenyl)-2-methyl-5-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(2-chlorophenyl)-2-methyl-5-phenylpyrrole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H26ClN3O3 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=CC=C3)C4=CC=CC=C4Cl)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC=CC=C3)C4=CC=CC=C4Cl)C

InChI

InChI=1S/C25H26ClN3O3/c1-3-32-25(31)28-15-13-27(14-16-28)24(30)20-17-23(19-9-5-4-6-10-19)29(18(20)2)22-12-8-7-11-21(22)26/h4-12,17H,3,13-16H2,1-2H3