ethyl 4-[2-[(4-chlorophenyl)carbonyl-ethyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-[(4-chlorophenyl)carbonyl-ethyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[(4-chlorobenzoyl)-ethyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[[(4-chlorophenyl)-oxomethyl]-ethylamino]-1-oxopropyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-chlorobenzoyl)-ethylamino]propanoyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[(4-chlorobenzoyl)-ethyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C22H27ClN2O4 MolecularWeight: 418.91378

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C)C(=O)C1=C(N(C(=C1C)C(=O)OCC)C)C)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(C(C)C(=O)C1=C(N(C(=C1C)C(=O)OCC)C)C)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H27ClN2O4/c1-7-25(21(27)16-9-11-17(23)12-10-16)15(5)20(26)18-13(3)19(22(28)29-8-2)24(6)14(18)4/h9-12,15H,7-8H2,1-6H3