1-phenoxytridecane-4-sulfonic acid

Systemtic Name: 1-phenoxytridecane-4-sulfonic acid Openeye Name: 1-phenoxytridecane-4-sulfonic acid CAS Name: 1-phenoxy-4-tridecanesulfonic acid IUPAC Name: 1-phenoxytridecane-4-sulfonic acid Traditional Name: 1-phenoxytridecane-4-sulfonic acid Formula: C19H32O4S MolecularWeight: 356.51998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCOC1=CC=CC=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCC(CCCOC1=CC=CC=C1)S(=O)(=O)O

InChI

InChI=1S/C19H32O4S/c1-2-3-4-5-6-7-11-15-19(24(20,21)22)16-12-17-23-18-13-9-8-10-14-18/h8-10,13-14,19H,2-7,11-12,15-17H2,1H3,(H,20,21,22)