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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H26N2O6S/c1-29-19-7-9-20(10-8-19)31(27,28)24-13-11-17(12-14-24)21(25)23-15-16-3-5-18(6-4-16)22(26)30-2/h3-10,17H,11-15H2,1-2H3,(H,23,25)