methyl 3-[[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylamino]-2-methyl-benzoate

Systemtic Name: methyl 3-[[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylamino]-2-methyl-benzoate Openeye Name: methyl 3-[[1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]amino]-2-methyl-benzoate CAS Name: 3-[[[1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]amino]-2-methylbenzoate Traditional Name: 3-[[1-(4-methoxyphenyl)sulfonylnipecotoyl]amino]-2-methyl-benzoic acid methyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C22H26N2O6S/c1-15-19(22(26)30-3)7-4-8-20(15)23-21(25)16-6-5-13-24(14-16)31(27,28)18-11-9-17(29-2)10-12-18/h4,7-12,16H,5-6,13-14H2,1-3H3,(H,23,25)