[3-[[(phenylmethyl)carbamoyl-propan-2-yl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[(phenylmethyl)carbamoyl-propan-2-yl-amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[benzylcarbamoyl(isopropyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[oxo-[(phenylmethyl)amino]methyl]-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [3-[[benzylcarbamoyl(propan-2-yl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[benzylcarbamoyl(isopropyl)amino]methyl]phenyl] ester Formula: C19H24N2O4S MolecularWeight: 376.46986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)N(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C19H24N2O4S/c1-15(2)21(19(22)20-13-16-8-5-4-6-9-16)14-17-10-7-11-18(12-17)25-26(3,23)24/h4-12,15H,13-14H2,1-3H3,(H,20,22)