dimethyl 2-[1-(phenylcarbonyl)cyclohexyl]-1H-pyrrole-3,4-dicarboxylate

Systemtic Name: dimethyl 2-[1-(phenylcarbonyl)cyclohexyl]-1H-pyrrole-3,4-dicarboxylate Openeye Name: dimethyl 2-(1-benzoylcyclohexyl)-1H-pyrrole-3,4-dicarboxylate CAS Name: 2-(1-benzoylcyclohexyl)-1H-pyrrole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(1-benzoylcyclohexyl)-1H-pyrrole-3,4-dicarboxylate Traditional Name: 2-(1-benzoylcyclohexyl)-1H-pyrrole-3,4-dicarboxylic acid dimethyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC(=C1C(=O)OC)C2(CCCCC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CNC(=C1C(=O)OC)C2(CCCCC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO5/c1-26-19(24)15-13-22-17(16(15)20(25)27-2)21(11-7-4-8-12-21)18(23)14-9-5-3-6-10-14/h3,5-6,9-10,13,22H,4,7-8,11-12H2,1-2H3