(4-methylphenyl) 5-azanylnaphthalene-2-sulfonate

Systemtic Name: (4-methylphenyl) 5-azanylnaphthalene-2-sulfonate Openeye Name: p-tolyl 5-aminonaphthalene-2-sulfonate CAS Name: 5-amino-2-naphthalenesulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 5-aminonaphthalene-2-sulfonate Traditional Name: 5-aminonaphthalene-2-sulfonic acid p-tolyl ester Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)C2=CC3=C(C=C2)C(=CC=C3)N

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)C2=CC3=C(C=C2)C(=CC=C3)N

InChI

InChI=1S/C17H15NO3S/c1-12-5-7-14(8-6-12)21-22(19,20)15-9-10-16-13(11-15)3-2-4-17(16)18/h2-11H,18H2,1H3