methyl 4-[[1-(4-chlorophenyl)carbonylpiperidin-4-ylidene]methyl]-2-methyl-benzoate

Systemtic Name: methyl 4-[[1-(4-chlorophenyl)carbonylpiperidin-4-ylidene]methyl]-2-methyl-benzoate Openeye Name: methyl 4-[[1-(4-chlorobenzoyl)-4-piperidylidene]methyl]-2-methyl-benzoate CAS Name: 4-[[1-[(4-chlorophenyl)-oxomethyl]-4-piperidinylidene]methyl]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[[1-(4-chlorobenzoyl)piperidin-4-ylidene]methyl]-2-methylbenzoate Traditional Name: 4-[[1-(4-chlorobenzoyl)-4-piperidylidene]methyl]-2-methyl-benzoic acid methyl ester Formula: C22H22ClNO3 MolecularWeight: 383.86798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)C=C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)C(=O)OC

InChI

InChI=1S/C22H22ClNO3/c1-15-13-17(3-8-20(15)22(26)27-2)14-16-9-11-24(12-10-16)21(25)18-4-6-19(23)7-5-18/h3-8,13-14H,9-12H2,1-2H3