[2-methoxy-5-[[octanoyl(propan-2-yl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [2-methoxy-5-[[octanoyl(propan-2-yl)amino]methyl]phenyl] methanesulfonate Openeye Name: [5-[[isopropyl(octanoyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-methoxy-5-[[1-oxooctyl(propan-2-yl)amino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[octanoyl(propan-2-yl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[caprylyl(isopropyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C20H33NO5S MolecularWeight: 399.54472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(C)C

Isomeric SMILES

CCCCCCCC(=O)N(CC1=CC(=C(C=C1)OC)OS(=O)(=O)C)C(C)C

InChI

InChI=1S/C20H33NO5S/c1-6-7-8-9-10-11-20(22)21(16(2)3)15-17-12-13-18(25-4)19(14-17)26-27(5,23)24/h12-14,16H,6-11,15H2,1-5H3