4-[1-butoxy-3-(4-methylphenoxy)propan-2-yl]oxybutane-1-sulfonate

Systemtic Name: 4-[1-butoxy-3-(4-methylphenoxy)propan-2-yl]oxybutane-1-sulfonate Openeye Name: 4-[1-(butoxymethyl)-2-(4-methylphenoxy)ethoxy]butane-1-sulfonate CAS Name: 4-[1-butoxy-3-(4-methylphenoxy)propan-2-yl]oxy-1-butanesulfonate IUPAC Name: 4-[1-butoxy-3-(4-methylphenoxy)propan-2-yl]oxybutane-1-sulfonate Traditional Name: 4-[1-(butoxymethyl)-2-(4-methylphenoxy)ethoxy]butane-1-sulfonate Formula: C18H29O6S- MolecularWeight: 373.48426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(COC1=CC=C(C=C1)C)OCCCCS(=O)(=O)[O-]

Isomeric SMILES

CCCCOCC(COC1=CC=C(C=C1)C)OCCCCS(=O)(=O)[O-]

InChI

InChI=1S/C18H30O6S/c1-3-4-11-22-14-18(23-12-5-6-13-25(19,20)21)15-24-17-9-7-16(2)8-10-17/h7-10,18H,3-6,11-15H2,1-2H3,(H,19,20,21)/p-1