[1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-chloranyl-3-(3-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [1-[(3-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-chloranyl-3-(3-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [2-(3-methoxyanilino)-1-methyl-2-oxo-ethyl] 4-chloro-3-[(3-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-chloro-3-[(3-methyl-1-piperidinyl)sulfonyl]benzoic acid [1-(3-methoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-methoxyanilino)-1-oxopropan-2-yl] 4-chloro-3-(3-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-chloro-3-(3-methylpiperidino)sulfonyl-benzoic acid [2-keto-2-(m-anisidino)-1-methyl-ethyl] ester Formula: C23H27ClN2O6S MolecularWeight: 494.98828

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C)C(=O)NC3=CC(=CC=C3)OC)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C)C(=O)NC3=CC(=CC=C3)OC)Cl

InChI

InChI=1S/C23H27ClN2O6S/c1-15-6-5-11-26(14-15)33(29,30)21-12-17(9-10-20(21)24)23(28)32-16(2)22(27)25-18-7-4-8-19(13-18)31-3/h4,7-10,12-13,15-16H,5-6,11,14H2,1-3H3,(H,25,27)