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

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

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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)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N2O6S/c1-15-6-7-16(22(26)30-3)13-20(15)23-21(25)17-5-4-12-24(14-17)31(27,28)19-10-8-18(29-2)9-11-19/h6-11,13,17H,4-5,12,14H2,1-3H3,(H,23,25)