5-[[4-[(4-acetamidophenyl)diazenyl]-7-sulfo-naphthalen-1-yl]diazenyl]-8-azanyl-naphthalene-2-sulfonic acid

Systemtic Name: 5-[[4-[(4-acetamidophenyl)diazenyl]-7-sulfo-naphthalen-1-yl]diazenyl]-8-azanyl-naphthalene-2-sulfonic acid Openeye Name: 5-[[4-(4-acetamidophenyl)azo-7-sulfo-1-naphthyl]azo]-8-amino-naphthalene-2-sulfonic acid CAS Name: 5-[[4-(4-acetamidophenyl)azo-7-sulfo-1-naphthalenyl]azo]-8-amino-2-naphthalenesulfonic acid IUPAC Name: 5-[[4-[(4-acetamidophenyl)diazenyl]-7-sulfonaphthalen-1-yl]diazenyl]-8-aminonaphthalene-2-sulfonic acid Traditional Name: 5-[[4-(4-acetamidophenyl)azo-7-sulfo-1-naphthyl]azo]-8-amino-naphthalene-2-sulfonic acid Formula: C28H22N6O7S2 MolecularWeight: 618.64028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N=NC2=C3C=CC(=CC3=C(C=C2)N=NC4=C5C=CC(=CC5=C(C=C4)N)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C28H22N6O7S2/c1-16(35)30-17-2-4-18(5-3-17)31-32-27-12-13-28(24-15-20(43(39,40)41)7-9-22(24)27)34-33-26-11-10-25(29)23-14-19(42(36,37)38)6-8-21(23)26/h2-15H,29H2,1H3,(H,30,35)(H,36,37,38)(H,39,40,41)