[3-[[phenylcarbonyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [3-[[phenylcarbonyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [3-[[benzoyl(isopropyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [3-[[benzoyl(propan-2-yl)amino]methyl]phenyl] ester IUPAC Name: [3-[[benzoyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [3-[[benzoyl(isopropyl)amino]methyl]phenyl] ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=CC(=C1)CN(C(C)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCS(=O)(=O)OC1=CC=CC(=C1)CN(C(C)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C19H23NO4S/c1-4-25(22,23)24-18-12-8-9-16(13-18)14-20(15(2)3)19(21)17-10-6-5-7-11-17/h5-13,15H,4,14H2,1-3H3