ethyl 1-[2-[(5-chloranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(5-chloranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(5-chloro-2-methoxy-phenyl)sulfonyl-methyl-amino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(5-chloro-2-methoxyphenyl)sulfonyl-methylamino]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(5-chloro-2-methoxyphenyl)sulfonyl-methylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(5-chloro-2-methoxy-phenyl)sulfonyl-methyl-amino]acetyl]isonipecotic acid ethyl ester Formula: C18H25ClN2O6S MolecularWeight: 432.9189

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN(C)S(=O)(=O)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C18H25ClN2O6S/c1-4-27-18(23)13-7-9-21(10-8-13)17(22)12-20(2)28(24,25)16-11-14(19)5-6-15(16)26-3/h5-6,11,13H,4,7-10,12H2,1-3H3