[4-[[3-methylbutyl(phenylcarbamoyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[3-methylbutyl(phenylcarbamoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[isopentyl(phenylcarbamoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[[anilino(oxo)methyl]-(3-methylbutyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[3-methylbutyl(phenylcarbamoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[isoamyl(phenylcarbamoyl)amino]methyl]phenyl] ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)CCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O4S/c1-16(2)13-14-22(20(23)21-18-7-5-4-6-8-18)15-17-9-11-19(12-10-17)26-27(3,24)25/h4-12,16H,13-15H2,1-3H3,(H,21,23)