(5-chloranyl-1-methyl-imidazol-2-yl)methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (5-chloranyl-1-methyl-imidazol-2-yl)methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (5-chloro-1-methyl-imidazol-2-yl)methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-3-piperidinecarboxylic acid (5-chloro-1-methyl-2-imidazolyl)methyl ester IUPAC Name: (5-chloro-1-methylimidazol-2-yl)methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylnipecotic acid (5-chloro-1-methyl-imidazol-2-yl)methyl ester Formula: C17H19Cl2N3O4S MolecularWeight: 432.32146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1COC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

CN1C(=CN=C1COC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H19Cl2N3O4S/c1-21-15(19)9-20-16(21)11-26-17(23)12-3-2-8-22(10-12)27(24,25)14-6-4-13(18)5-7-14/h4-7,9,12H,2-3,8,10-11H2,1H3