[2-methoxy-5-[[propan-2-yl(tetradecanoyl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [2-methoxy-5-[[propan-2-yl(tetradecanoyl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [5-[[isopropyl(tetradecanoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [2-methoxy-5-[[1-oxotetradecyl(propan-2-yl)amino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[propan-2-yl(tetradecanoyl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[isopropyl(tetradecanoyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C27H47NO5S MolecularWeight: 497.73078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H47NO5S/c1-6-8-9-10-11-12-13-14-15-16-17-18-27(29)28(23(3)4)22-24-19-20-25(32-5)26(21-24)33-34(30,31)7-2/h19-21,23H,6-18,22H2,1-5H3