methyl 4-[[[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[(1-mesitylsulfonylisonipecotoyl)amino]methyl]benzoic acid methyl ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C24H30N2O5S/c1-16-13-17(2)22(18(3)14-16)32(29,30)26-11-9-20(10-12-26)23(27)25-15-19-5-7-21(8-6-19)24(28)31-4/h5-8,13-14,20H,9-12,15H2,1-4H3,(H,25,27)