7-methyloctyl 2-ethylnaphthalene-1-sulfonate

Systemtic Name: 7-methyloctyl 2-ethylnaphthalene-1-sulfonate Openeye Name: 7-methyloctyl 2-ethylnaphthalene-1-sulfonate CAS Name: 2-ethyl-1-naphthalenesulfonic acid 7-methyloctyl ester IUPAC Name: 7-methyloctyl 2-ethylnaphthalene-1-sulfonate Traditional Name: 2-ethylnaphthalene-1-sulfonic acid 7-methyloctyl ester Formula: C21H30O3S MolecularWeight: 362.5261

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)OCCCCCCC(C)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)OCCCCCCC(C)C

InChI

InChI=1S/C21H30O3S/c1-4-18-14-15-19-12-8-9-13-20(19)21(18)25(22,23)24-16-10-6-5-7-11-17(2)3/h8-9,12-15,17H,4-7,10-11,16H2,1-3H3