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

Systemtic Name: [4-[[butan-2-yl(propan-2-ylcarbamoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[isopropylcarbamoyl(sec-butyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[butan-2-yl-[oxo-(propan-2-ylamino)methyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[butan-2-yl(propan-2-ylcarbamoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[isopropylcarbamoyl(sec-butyl)amino]methyl]phenyl] ester Formula: C16H26N2O4S MolecularWeight: 342.45364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC(C)C

Isomeric SMILES

CCC(C)N(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC(C)C

InChI

InChI=1S/C16H26N2O4S/c1-6-13(4)18(16(19)17-12(2)3)11-14-7-9-15(10-8-14)22-23(5,20)21/h7-10,12-13H,6,11H2,1-5H3,(H,17,19)