8-[(3-methylphenyl)amino]octane-1-sulfonic acid

Systemtic Name: 8-[(3-methylphenyl)amino]octane-1-sulfonic acid Openeye Name: 8-(3-methylanilino)octane-1-sulfonic acid CAS Name: 8-(3-methylanilino)-1-octanesulfonic acid IUPAC Name: 8-(3-methylanilino)octane-1-sulfonic acid Traditional Name: 8-(m-toluidino)octane-1-sulfonic acid Formula: C15H25NO3S MolecularWeight: 299.4289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NCCCCCCCCS(=O)(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NCCCCCCCCS(=O)(=O)O

InChI

InChI=1S/C15H25NO3S/c1-14-9-8-10-15(13-14)16-11-6-4-2-3-5-7-12-20(17,18)19/h8-10,13,16H,2-7,11-12H2,1H3,(H,17,18,19)