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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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