methyl 4-[1-(4-chlorophenyl)-6-oxidanylidene-piperidin-3-yl]-2-methoxy-benzoate

Systemtic Name: methyl 4-[1-(4-chlorophenyl)-6-oxidanylidene-piperidin-3-yl]-2-methoxy-benzoate Openeye Name: methyl 4-[1-(4-chlorophenyl)-6-oxo-3-piperidyl]-2-methoxy-benzoate CAS Name: 4-[1-(4-chlorophenyl)-6-oxo-3-piperidinyl]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[1-(4-chlorophenyl)-6-oxopiperidin-3-yl]-2-methoxybenzoate Traditional Name: 4-[1-(4-chlorophenyl)-6-keto-3-piperidyl]-2-methoxy-benzoic acid methyl ester Formula: C20H20ClNO4 MolecularWeight: 373.8301

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2CCC(=O)N(C2)C3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C2CCC(=O)N(C2)C3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C20H20ClNO4/c1-25-18-11-13(3-9-17(18)20(24)26-2)14-4-10-19(23)22(12-14)16-7-5-15(21)6-8-16/h3,5-9,11,14H,4,10,12H2,1-2H3