[4-[[[(2R)-butan-2-yl]-pentanoyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[[(2R)-butan-2-yl]-pentanoyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[[(1R)-1-methylpropyl]-pentanoyl-amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[[(2R)-butan-2-yl]-(1-oxopentyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[[(2R)-butan-2-yl]-pentanoylamino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[[(1R)-1-methylpropyl]-valeryl-amino]methyl]phenyl] ester Formula: C17H27NO4S MolecularWeight: 341.46558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC=C(C=C1)OS(=O)(=O)C)C(C)CC

Isomeric SMILES

CCCCC(=O)N(CC1=CC=C(C=C1)OS(=O)(=O)C)[C@H](C)CC

InChI

InChI=1S/C17H27NO4S/c1-5-7-8-17(19)18(14(3)6-2)13-15-9-11-16(12-10-15)22-23(4,20)21/h9-12,14H,5-8,13H2,1-4H3/t14-/m1/s1