8-[(2-azanyl-6-methyl-phenyl)diazenyl]-5-[(1-sulfonaphthalen-2-yl)diazenyl]naphthalene-2-sulfonic acid

Systemtic Name: 8-[(2-azanyl-6-methyl-phenyl)diazenyl]-5-[(1-sulfonaphthalen-2-yl)diazenyl]naphthalene-2-sulfonic acid Openeye Name: 8-(2-amino-6-methyl-phenyl)azo-5-[(1-sulfo-2-naphthyl)azo]naphthalene-2-sulfonic acid CAS Name: 8-(2-amino-6-methylphenyl)azo-5-[(1-sulfo-2-naphthalenyl)azo]-2-naphthalenesulfonic acid IUPAC Name: 8-[(2-amino-6-methylphenyl)diazenyl]-5-[(1-sulfonaphthalen-2-yl)diazenyl]naphthalene-2-sulfonic acid Traditional Name: 8-(2-amino-6-methyl-phenyl)azo-5-[(1-sulfo-2-naphthyl)azo]naphthalene-2-sulfonic acid Formula: C27H21N5O6S2 MolecularWeight: 575.61554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N)N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C(C5=CC=CC=C5C=C4)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)N)N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=C(C5=CC=CC=C5C=C4)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C27H21N5O6S2/c1-16-5-4-8-22(28)26(16)32-30-24-14-13-23(20-11-10-18(15-21(20)24)39(33,34)35)29-31-25-12-9-17-6-2-3-7-19(17)27(25)40(36,37)38/h2-15H,28H2,1H3,(H,33,34,35)(H,36,37,38)