[4-[[phenylcarbonyl-(phenylmethyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[phenylcarbonyl-(phenylmethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[benzoyl(benzyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[benzoyl-(phenylmethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[benzoyl(benzyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[benzoyl(benzyl)amino]methyl]phenyl] ester Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)OC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21NO4S/c1-28(25,26)27-21-14-12-19(13-15-21)17-23(16-18-8-4-2-5-9-18)22(24)20-10-6-3-7-11-20/h2-15H,16-17H2,1H3