3-[(4-azanyl-2-methyl-phenyl)diazenyl]naphthalene-1,5-disulfonic acid

Systemtic Name: 3-[(4-azanyl-2-methyl-phenyl)diazenyl]naphthalene-1,5-disulfonic acid Openeye Name: 3-(4-amino-2-methyl-phenyl)azonaphthalene-1,5-disulfonic acid CAS Name: 3-(4-amino-2-methylphenyl)azonaphthalene-1,5-disulfonic acid IUPAC Name: 3-[(4-amino-2-methylphenyl)diazenyl]naphthalene-1,5-disulfonic acid Traditional Name: 3-(4-amino-2-methyl-phenyl)azonaphthalene-1,5-disulfonic acid Formula: C17H15N3O6S2 MolecularWeight: 421.4475

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O6S2/c1-10-7-11(18)5-6-15(10)20-19-12-8-14-13(17(9-12)28(24,25)26)3-2-4-16(14)27(21,22)23/h2-9H,18H2,1H3,(H,21,22,23)(H,24,25,26)