methyl 4,5-dimethoxy-2-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[(1-methylsulfonylpiperidin-4-yl)carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[(1-methylsulfonylpiperidine-4-carbonyl)amino]benzoate CAS Name: 4,5-dimethoxy-2-[[(1-methylsulfonyl-4-piperidinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[(1-methylsulfonylpiperidine-4-carbonyl)amino]benzoate Traditional Name: 2-[(1-mesylisonipecotoyl)amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C17H24N2O7S MolecularWeight: 400.44666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2CCN(CC2)S(=O)(=O)C)OC

InChI

InChI=1S/C17H24N2O7S/c1-24-14-9-12(17(21)26-3)13(10-15(14)25-2)18-16(20)11-5-7-19(8-6-11)27(4,22)23/h9-11H,5-8H2,1-4H3,(H,18,20)