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

Systemtic Name: [5-[[dodecanoyl(propan-2-yl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate Openeye Name: [5-[[dodecanoyl(isopropyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [2-methoxy-5-[[1-oxododecyl(propan-2-yl)amino]methyl]phenyl] ester IUPAC Name: [5-[[dodecanoyl(propan-2-yl)amino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[isopropyl(lauroyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C25H43NO5S MolecularWeight: 469.67762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H43NO5S/c1-6-8-9-10-11-12-13-14-15-16-25(27)26(21(3)4)20-22-17-18-23(30-5)24(19-22)31-32(28,29)7-2/h17-19,21H,6-16,20H2,1-5H3