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

Systemtic Name: [3-[[2-methoxyethyl(nonanoyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[2-methoxyethyl(nonanoyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[2-methoxyethyl(1-oxononyl)amino]methyl]phenyl] ester IUPAC Name: [3-[[2-methoxyethyl(nonanoyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[2-methoxyethyl(pelargonyl)amino]methyl]phenyl] ester Formula: C20H33NO5S MolecularWeight: 399.54472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33NO5S/c1-4-5-6-7-8-9-13-20(22)21(14-15-25-2)17-18-11-10-12-19(16-18)26-27(3,23)24/h10-12,16H,4-9,13-15,17H2,1-3H3