[4-[[2-methylpropanoyl-(phenylmethyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[2-methylpropanoyl-(phenylmethyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[benzyl(2-methylpropanoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[(2-methyl-1-oxopropyl)-(phenylmethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[benzyl(2-methylpropanoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[benzyl(isobutyryl)amino]methyl]phenyl] ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO4S/c1-15(2)19(21)20(13-16-7-5-4-6-8-16)14-17-9-11-18(12-10-17)24-25(3,22)23/h4-12,15H,13-14H2,1-3H3