6-azanyl-5-[[4-[4-[(2-azanyl-6-sulfo-naphthalen-1-yl)diazenyl]-3-methyl-phenyl]-2-methyl-phenyl]diazenyl]naphthalene-2-sulfonic acid

Systemtic Name: 6-azanyl-5-[[4-[4-[(2-azanyl-6-sulfo-naphthalen-1-yl)diazenyl]-3-methyl-phenyl]-2-methyl-phenyl]diazenyl]naphthalene-2-sulfonic acid Openeye Name: 6-amino-5-[4-[4-[(2-amino-6-sulfo-1-naphthyl)azo]-3-methyl-phenyl]-2-methyl-phenyl]azo-naphthalene-2-sulfonic acid CAS Name: 6-amino-5-[4-[4-[(2-amino-6-sulfo-1-naphthalenyl)azo]-3-methylphenyl]-2-methylphenyl]azo-2-naphthalenesulfonic acid IUPAC Name: 6-amino-5-[[4-[4-[(2-amino-6-sulfonaphthalen-1-yl)diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]naphthalene-2-sulfonic acid Traditional Name: 6-amino-5-[4-[4-[(2-amino-6-sulfo-1-naphthyl)azo]-3-methyl-phenyl]-2-methyl-phenyl]azo-naphthalene-2-sulfonic acid Formula: C34H28N6O6S2 MolecularWeight: 680.75272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=CC4=C3C=CC(=C4)S(=O)(=O)O)N)C)N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)O)N

Isomeric SMILES

CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C=CC4=C3C=CC(=C4)S(=O)(=O)O)N)C)N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)O)N

InChI

InChI=1S/C34H28N6O6S2/c1-19-15-21(5-13-31(19)37-39-33-27-9-7-25(47(41,42)43)17-23(27)3-11-29(33)35)22-6-14-32(20(2)16-22)38-40-34-28-10-8-26(48(44,45)46)18-24(28)4-12-30(34)36/h3-18H,35-36H2,1-2H3,(H,41,42,43)(H,44,45,46)