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

Systemtic Name: methyl 3-[[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]amino]benzoate CAS Name: 3-[[[1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]amino]benzoate Traditional Name: 3-[[1-(4-methoxyphenyl)sulfonylnipecotoyl]amino]benzoic acid methyl ester Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C21H24N2O6S/c1-28-18-8-10-19(11-9-18)30(26,27)23-12-4-6-16(14-23)20(24)22-17-7-3-5-15(13-17)21(25)29-2/h3,5,7-11,13,16H,4,6,12,14H2,1-2H3,(H,22,24)