[4-[[(3,4-dimethylphenyl)carbamoyl-(phenylmethyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(3,4-dimethylphenyl)carbamoyl-(phenylmethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[benzyl-[(3,4-dimethylphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[[(3,4-dimethylanilino)-oxomethyl]-(phenylmethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[benzyl-[(3,4-dimethylphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[benzyl-[(3,4-dimethylphenyl)carbamoyl]amino]methyl]phenyl] ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)OS(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(CC2=CC=CC=C2)CC3=CC=C(C=C3)OS(=O)(=O)C)C

InChI

InChI=1S/C24H26N2O4S/c1-18-9-12-22(15-19(18)2)25-24(27)26(16-20-7-5-4-6-8-20)17-21-10-13-23(14-11-21)30-31(3,28)29/h4-15H,16-17H2,1-3H3,(H,25,27)