ethyl 4-[2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]ethanoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[4-(4-chlorobenzoyl)piperazin-1-yl]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[2-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-1-oxoethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[4-(4-chlorobenzoyl)piperazin-1-yl]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[4-(4-chlorobenzoyl)piperazino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C22H26ClN3O4 MolecularWeight: 431.91254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H26ClN3O4/c1-4-30-22(29)20-14(2)19(15(3)24-20)18(27)13-25-9-11-26(12-10-25)21(28)16-5-7-17(23)8-6-16/h5-8,24H,4,9-13H2,1-3H3