7-[(4-azanyl-2-methyl-phenyl)diazenyl]naphthalene-1,3,5-trisulfonic acid

Systemtic Name: 7-[(4-azanyl-2-methyl-phenyl)diazenyl]naphthalene-1,3,5-trisulfonic acid Openeye Name: 7-(4-amino-2-methyl-phenyl)azonaphthalene-1,3,5-trisulfonic acid CAS Name: 7-(4-amino-2-methylphenyl)azonaphthalene-1,3,5-trisulfonic acid IUPAC Name: 7-[(4-amino-2-methylphenyl)diazenyl]naphthalene-1,3,5-trisulfonic acid Traditional Name: 7-(4-amino-2-methyl-phenyl)azonaphthalene-1,3,5-trisulfonic acid Formula: C17H15N3O9S3 MolecularWeight: 501.5107

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O9S3/c1-9-4-10(18)2-3-15(9)20-19-11-5-13-14(16(6-11)31(24,25)26)7-12(30(21,22)23)8-17(13)32(27,28)29/h2-8H,18H2,1H3,(H,21,22,23)(H,24,25,26)(H,27,28,29)