7-methyloctyl 2-methylnaphthalene-1-sulfonate

Systemtic Name: 7-methyloctyl 2-methylnaphthalene-1-sulfonate Openeye Name: 7-methyloctyl 2-methylnaphthalene-1-sulfonate CAS Name: 2-methyl-1-naphthalenesulfonic acid 7-methyloctyl ester IUPAC Name: 7-methyloctyl 2-methylnaphthalene-1-sulfonate Traditional Name: 2-methylnaphthalene-1-sulfonic acid 7-methyloctyl ester Formula: C20H28O3S MolecularWeight: 348.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)OCCCCCCC(C)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2C=C1)S(=O)(=O)OCCCCCCC(C)C

InChI

InChI=1S/C20H28O3S/c1-16(2)10-6-4-5-9-15-23-24(21,22)20-17(3)13-14-18-11-7-8-12-19(18)20/h7-8,11-14,16H,4-6,9-10,15H2,1-3H3