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

Systemtic Name: methyl 3-[[1-(4-propan-2-ylphenyl)sulfonylpiperidin-4-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[1-(4-isopropylphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carbonyl]amino]benzoate Traditional Name: 3-[(1-p-cumenylsulfonylisonipecotoyl)amino]benzoic acid methyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C23H28N2O5S/c1-16(2)17-7-9-21(10-8-17)31(28,29)25-13-11-18(12-14-25)22(26)24-20-6-4-5-19(15-20)23(27)30-3/h4-10,15-16,18H,11-14H2,1-3H3,(H,24,26)