8-[(4-acetamidophenyl)diazenyl]-7-azanyl-naphthalene-1,3-disulfonic acid

Systemtic Name: 8-[(4-acetamidophenyl)diazenyl]-7-azanyl-naphthalene-1,3-disulfonic acid Openeye Name: 8-(4-acetamidophenyl)azo-7-amino-naphthalene-1,3-disulfonic acid CAS Name: 8-(4-acetamidophenyl)azo-7-aminonaphthalene-1,3-disulfonic acid IUPAC Name: 8-[(4-acetamidophenyl)diazenyl]-7-aminonaphthalene-1,3-disulfonic acid Traditional Name: 8-(4-acetamidophenyl)azo-7-amino-naphthalene-1,3-disulfonic acid Formula: C18H16N4O7S2 MolecularWeight: 464.47224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N=NC2=C(C=CC3=CC(=CC(=C32)S(=O)(=O)O)S(=O)(=O)O)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N=NC2=C(C=CC3=CC(=CC(=C32)S(=O)(=O)O)S(=O)(=O)O)N

InChI

InChI=1S/C18H16N4O7S2/c1-10(23)20-12-3-5-13(6-4-12)21-22-18-15(19)7-2-11-8-14(30(24,25)26)9-16(17(11)18)31(27,28)29/h2-9H,19H2,1H3,(H,20,23)(H,24,25,26)(H,27,28,29)