4-(3-methylphenoxy)butane-1-sulfonic acid

Systemtic Name: 4-(3-methylphenoxy)butane-1-sulfonic acid Openeye Name: 4-(3-methylphenoxy)butane-1-sulfonic acid CAS Name: 4-(3-methylphenoxy)-1-butanesulfonic acid IUPAC Name: 4-(3-methylphenoxy)butane-1-sulfonic acid Traditional Name: 4-(3-methylphenoxy)butane-1-sulfonic acid Formula: C11H16O4S MolecularWeight: 244.30734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCCS(=O)(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCCCCS(=O)(=O)O

InChI

InChI=1S/C11H16O4S/c1-10-5-4-6-11(9-10)15-7-2-3-8-16(12,13)14/h4-6,9H,2-3,7-8H2,1H3,(H,12,13,14)