5-[(3-nitrophenyl)diazenyl]-8-phenylazanyl-naphthalene-1-sulfonic acid

Systemtic Name: 5-[(3-nitrophenyl)diazenyl]-8-phenylazanyl-naphthalene-1-sulfonic acid Openeye Name: 8-anilino-5-(3-nitrophenyl)azo-naphthalene-1-sulfonic acid CAS Name: 8-anilino-5-(3-nitrophenyl)azo-1-naphthalenesulfonic acid IUPAC Name: 8-anilino-5-[(3-nitrophenyl)diazenyl]naphthalene-1-sulfonic acid Traditional Name: 8-anilino-5-(3-nitrophenyl)azo-naphthalene-1-sulfonic acid Formula: C22H16N4O5S MolecularWeight: 448.45124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=CC(=CC=C4)[N+](=O)[O-])C=CC=C3S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=CC(=CC=C4)[N+](=O)[O-])C=CC=C3S(=O)(=O)O

InChI

InChI=1S/C22H16N4O5S/c27-26(28)17-9-4-8-16(14-17)24-25-19-12-13-20(23-15-6-2-1-3-7-15)22-18(19)10-5-11-21(22)32(29,30)31/h1-14,23H,(H,29,30,31)