[3-[[2-methoxyethyl(octanoyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[2-methoxyethyl(octanoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[2-methoxyethyl(octanoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[2-methoxyethyl(1-oxooctyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[2-methoxyethyl(octanoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[caprylyl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C19H31NO5S MolecularWeight: 385.51814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H31NO5S/c1-4-5-6-7-8-12-19(21)20(13-14-24-2)16-17-10-9-11-18(15-17)25-26(3,22)23/h9-11,15H,4-8,12-14,16H2,1-3H3