[3-[(4-methylphenyl)carbonylamino]phenyl] 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [3-[(4-methylphenyl)carbonylamino]phenyl] 3-piperidin-1-ylsulfonylbenzoate Openeye Name: [3-[(4-methylbenzoyl)amino]phenyl] 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid [3-[[(4-methylphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [3-[(4-methylbenzoyl)amino]phenyl] 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid [3-(p-toluoylamino)phenyl] ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H26N2O5S/c1-19-11-13-20(14-12-19)25(29)27-22-8-6-9-23(18-22)33-26(30)21-7-5-10-24(17-21)34(31,32)28-15-3-2-4-16-28/h5-14,17-18H,2-4,15-16H2,1H3,(H,27,29)