methyl 1-[2-[(3-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(3-chloranyl-2-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[3-chloro-2-methyl-N-(p-tolylsulfonyl)anilino]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(3-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-chloro-2-methyl-N-(4-methylphenyl)sulfonylanilino)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3-chloro-2-methyl-N-tosyl-anilino)acetyl]isonipecotic acid methyl ester Formula: C23H27ClN2O5S MolecularWeight: 478.98888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)OC)C3=C(C(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCC(CC2)C(=O)OC)C3=C(C(=CC=C3)Cl)C

InChI

InChI=1S/C23H27ClN2O5S/c1-16-7-9-19(10-8-16)32(29,30)26(21-6-4-5-20(24)17(21)2)15-22(27)25-13-11-18(12-14-25)23(28)31-3/h4-10,18H,11-15H2,1-3H3