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

Systemtic Name: ethyl 4-[2-[(4-chlorophenyl)carbonyl-cyclohexyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[(4-chlorobenzoyl)-cyclohexyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[[(4-chlorophenyl)-oxomethyl]-cyclohexylamino]-1-oxopropyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-chlorobenzoyl)-cyclohexylamino]propanoyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[(4-chlorobenzoyl)-cyclohexyl-amino]propanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C26H33ClN2O4 MolecularWeight: 473.00422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)C(C)N(C2CCCCC2)C(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)C(C)N(C2CCCCC2)C(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C26H33ClN2O4/c1-6-33-26(32)23-16(2)22(17(3)28(23)5)24(30)18(4)29(21-10-8-7-9-11-21)25(31)19-12-14-20(27)15-13-19/h12-15,18,21H,6-11H2,1-5H3