7-[[5-acetamido-2-methoxy-4-[(6-sulfonaphthalen-2-yl)diazenyl]phenyl]diazenyl]-8-azanyl-naphthalene-1-sulfonic acid

Systemtic Name: 7-[[5-acetamido-2-methoxy-4-[(6-sulfonaphthalen-2-yl)diazenyl]phenyl]diazenyl]-8-azanyl-naphthalene-1-sulfonic acid Openeye Name: 7-[5-acetamido-2-methoxy-4-[(6-sulfo-2-naphthyl)azo]phenyl]azo-8-amino-naphthalene-1-sulfonic acid CAS Name: 7-[5-acetamido-2-methoxy-4-[(6-sulfo-2-naphthalenyl)azo]phenyl]azo-8-amino-1-naphthalenesulfonic acid IUPAC Name: 7-[[5-acetamido-2-methoxy-4-[(6-sulfonaphthalen-2-yl)diazenyl]phenyl]diazenyl]-8-aminonaphthalene-1-sulfonic acid Traditional Name: 7-[5-acetamido-2-methoxy-4-[(6-sulfo-2-naphthyl)azo]phenyl]azo-8-amino-naphthalene-1-sulfonic acid Formula: C29H24N6O8S2 MolecularWeight: 648.66626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1)N=NC2=C(C3=C(C=CC=C3S(=O)(=O)O)C=C2)N)OC)N=NC4=CC5=C(C=C4)C=C(C=C5)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1)N=NC2=C(C3=C(C=CC=C3S(=O)(=O)O)C=C2)N)OC)N=NC4=CC5=C(C=C4)C=C(C=C5)S(=O)(=O)O

InChI

InChI=1S/C29H24N6O8S2/c1-16(36)31-23-14-25(35-33-22-11-8-17-4-3-5-27(45(40,41)42)28(17)29(22)30)26(43-2)15-24(23)34-32-20-9-6-19-13-21(44(37,38)39)10-7-18(19)12-20/h3-15H,30H2,1-2H3,(H,31,36)(H,37,38,39)(H,40,41,42)