2-[(4-methylphenyl)amino]naphthalene-1-sulfonic acid

Systemtic Name: 2-[(4-methylphenyl)amino]naphthalene-1-sulfonic acid Openeye Name: 2-(4-methylanilino)naphthalene-1-sulfonic acid CAS Name: 2-(4-methylanilino)-1-naphthalenesulfonic acid IUPAC Name: 2-(4-methylanilino)naphthalene-1-sulfonic acid Traditional Name: 2-(p-toluidino)naphthalene-1-sulfonic acid Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C3=CC=CC=C3C=C2)S(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C3=CC=CC=C3C=C2)S(=O)(=O)O

InChI

InChI=1S/C17H15NO3S/c1-12-6-9-14(10-7-12)18-16-11-8-13-4-2-3-5-15(13)17(16)22(19,20)21/h2-11,18H,1H3,(H,19,20,21)