[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 1-(3-chlorophenyl)cyclohexane-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 1-(3-chlorophenyl)cyclohexane-1-carboxylate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1-(3-chlorophenyl)cyclohexanecarboxylate CAS Name: 1-(3-chlorophenyl)-1-cyclohexanecarboxylic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1-(3-chlorophenyl)cyclohexane-1-carboxylate Traditional Name: 1-(3-chlorophenyl)cyclohexanecarboxylic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C19H20ClNO3 MolecularWeight: 345.82

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C2=CC(=CC=C2)Cl)C(=O)OCC(=O)C3=CC=CN3

Isomeric SMILES

C1CCC(CC1)(C2=CC(=CC=C2)Cl)C(=O)OCC(=O)C3=CC=CN3

InChI

InChI=1S/C19H20ClNO3/c20-15-7-4-6-14(12-15)19(9-2-1-3-10-19)18(23)24-13-17(22)16-8-5-11-21-16/h4-8,11-12,21H,1-3,9-10,13H2