[5-[[butan-2-yl(decanoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate

Systemtic Name: [5-[[butan-2-yl(decanoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate Openeye Name: [5-[[decanoyl(sec-butyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-[[butan-2-yl(1-oxodecyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[butan-2-yl(decanoyl)amino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[capryl(sec-butyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C24H41NO5S MolecularWeight: 455.65104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H41NO5S/c1-6-9-10-11-12-13-14-15-24(26)25(20(4)7-2)19-21-16-17-22(29-5)23(18-21)30-31(27,28)8-3/h16-18,20H,6-15,19H2,1-5H3