[3-[[[(2R)-butan-2-yl]-naphthalen-1-ylcarbonyl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[[(2R)-butan-2-yl]-naphthalen-1-ylcarbonyl-amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[[(1R)-1-methylpropyl]-(naphthalene-1-carbonyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[(2R)-butan-2-yl]-[1-naphthalenyl(oxo)methyl]amino]methyl]phenyl] ester IUPAC Name: [3-[[[(2R)-butan-2-yl]-(naphthalene-1-carbonyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[[(1R)-1-methylpropyl]-(1-naphthoyl)amino]methyl]phenyl] ester Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC[C@@H](C)N(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H25NO4S/c1-4-17(2)24(16-18-9-7-12-20(15-18)28-29(3,26)27)23(25)22-14-8-11-19-10-5-6-13-21(19)22/h5-15,17H,4,16H2,1-3H3/t17-/m1/s1