methyl 4-methyl-3-[(1-methylsulfonylpiperidin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[(1-methylsulfonylpiperidin-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[(1-methylsulfonylpiperidine-3-carbonyl)amino]benzoate CAS Name: 4-methyl-3-[[(1-methylsulfonyl-3-piperidinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(1-methylsulfonylpiperidine-3-carbonyl)amino]benzoate Traditional Name: 3-[(1-mesylnipecotoyl)amino]-4-methyl-benzoic acid methyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCCN(C2)S(=O)(=O)C

InChI

InChI=1S/C16H22N2O5S/c1-11-6-7-12(16(20)23-2)9-14(11)17-15(19)13-5-4-8-18(10-13)24(3,21)22/h6-7,9,13H,4-5,8,10H2,1-3H3,(H,17,19)