sodium methoxy [5-methoxy-3-methyl-4-oxidanyl-2-(10-oxidanyldecyl)phenyl] sulfate

Systemtic Name: sodium methoxy [5-methoxy-3-methyl-4-oxidanyl-2-(10-oxidanyldecyl)phenyl] sulfate Openeye Name: sodium [4-hydroxy-2-(10-hydroxydecyl)-5-methoxy-3-methyl-phenyl] methoxy sulfate CAS Name: sodium sulfuric acid [4-hydroxy-2-(10-hydroxydecyl)-5-methoxy-3-methylphenyl] methoxy ester IUPAC Name: sodium [4-hydroxy-2-(10-hydroxydecyl)-5-methoxy-3-methylphenyl] methoxy sulfate Traditional Name: sodium sulfuric acid [4-hydroxy-2-(10-hydroxydecyl)-5-methoxy-3-methyl-phenyl] methoxy ester Formula: C19H32NaO8S+ MolecularWeight: 443.50735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1O)OC)OS(=O)(=O)OOC)CCCCCCCCCCO.[Na+]

Isomeric SMILES

CC1=C(C(=CC(=C1O)OC)OS(=O)(=O)OOC)CCCCCCCCCCO.[Na+]

InChI

InChI=1S/C19H32O8S.Na/c1-15-16(12-10-8-6-4-5-7-9-11-13-20)17(14-18(24-2)19(15)21)26-28(22,23)27-25-3;/h14,20-21H,4-13H2,1-3H3;/q;+1