[4-[[butan-2-yl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[butan-2-yl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[1-naphthylcarbamoyl(sec-butyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[butan-2-yl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[butan-2-yl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[1-naphthylcarbamoyl(sec-butyl)amino]methyl]phenyl] ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H26N2O4S/c1-4-17(2)25(16-18-12-14-20(15-13-18)29-30(3,27)28)23(26)24-22-11-7-9-19-8-5-6-10-21(19)22/h5-15,17H,4,16H2,1-3H3,(H,24,26)