[1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 2-methyl-5-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 2-methyl-5-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid [1-(3-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-methylanilino)-1-oxopropan-2-yl] 2-methyl-5-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 2-methyl-5-(2-methylpiperidino)sulfonyl-benzoic acid [2-keto-1-methyl-2-(m-toluidino)ethyl] ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OC(C)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)OC(C)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C24H30N2O5S/c1-16-8-7-10-20(14-16)25-23(27)19(4)31-24(28)22-15-21(12-11-17(22)2)32(29,30)26-13-6-5-9-18(26)3/h7-8,10-12,14-15,18-19H,5-6,9,13H2,1-4H3,(H,25,27)