methyl 3-bromanyl-4-[[1-(4-chlorophenyl)carbonylpiperidin-4-ylidene]methyl]benzoate

Systemtic Name: methyl 3-bromanyl-4-[[1-(4-chlorophenyl)carbonylpiperidin-4-ylidene]methyl]benzoate Openeye Name: methyl 3-bromo-4-[[1-(4-chlorobenzoyl)-4-piperidylidene]methyl]benzoate CAS Name: 3-bromo-4-[[1-[(4-chlorophenyl)-oxomethyl]-4-piperidinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-bromo-4-[[1-(4-chlorobenzoyl)piperidin-4-ylidene]methyl]benzoate Traditional Name: 3-bromo-4-[[1-(4-chlorobenzoyl)-4-piperidylidene]methyl]benzoic acid methyl ester Formula: C21H19BrClNO3 MolecularWeight: 448.73746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C=C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)Br

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C=C2CCN(CC2)C(=O)C3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C21H19BrClNO3/c1-27-21(26)17-3-2-16(19(22)13-17)12-14-8-10-24(11-9-14)20(25)15-4-6-18(23)7-5-15/h2-7,12-13H,8-11H2,1H3