1-[[4-[(4,7-dimethylnaphthalen-1-yl)diazenyl]naphthalen-1-yl]diazenyl]-5-methyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 1-[[4-[(4,7-dimethylnaphthalen-1-yl)diazenyl]naphthalen-1-yl]diazenyl]-5-methyl-naphthalene-2,7-disulfonic acid Openeye Name: 1-[[4-[(4,7-dimethyl-1-naphthyl)azo]-1-naphthyl]azo]-5-methyl-naphthalene-2,7-disulfonic acid CAS Name: 1-[[4-[(4,7-dimethyl-1-naphthalenyl)azo]-1-naphthalenyl]azo]-5-methylnaphthalene-2,7-disulfonic acid IUPAC Name: 1-[[4-[(4,7-dimethylnaphthalen-1-yl)diazenyl]naphthalen-1-yl]diazenyl]-5-methylnaphthalene-2,7-disulfonic acid Traditional Name: 1-[[4-[(4,7-dimethyl-1-naphthyl)azo]-1-naphthyl]azo]-5-methyl-naphthalene-2,7-disulfonic acid Formula: C33H26N4O6S2 MolecularWeight: 638.71274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC(=C2C=C1)C)N=NC3=CC=C(C4=CC=CC=C43)N=NC5=C(C=CC6=C(C=C(C=C65)S(=O)(=O)O)C)S(=O)(=O)O

Isomeric SMILES

CC1=CC2=C(C=CC(=C2C=C1)C)N=NC3=CC=C(C4=CC=CC=C43)N=NC5=C(C=CC6=C(C=C(C=C65)S(=O)(=O)O)C)S(=O)(=O)O

InChI

InChI=1S/C33H26N4O6S2/c1-19-8-10-23-20(2)9-12-31(27(23)16-19)35-34-29-13-14-30(26-7-5-4-6-25(26)29)36-37-33-28-18-22(44(38,39)40)17-21(3)24(28)11-15-32(33)45(41,42)43/h4-18H,1-3H3,(H,38,39,40)(H,41,42,43)