8-[[4-[[4-[[4-[(4-aminophenyl)carbonylamino]-5-methoxy-2-methyl-phenyl]diazenyl]-2,5-dimethoxy-phenyl]diazenyl]-5-methoxy-2-methyl-phenyl]diazenyl]naphthalene-1,6-disulfonic acid

Systemtic Name: 8-[[4-[[4-[[4-[(4-aminophenyl)carbonylamino]-5-methoxy-2-methyl-phenyl]diazenyl]-2,5-dimethoxy-phenyl]diazenyl]-5-methoxy-2-methyl-phenyl]diazenyl]naphthalene-1,6-disulfonic acid Openeye Name: 8-[4-[4-[4-[(4-aminobenzoyl)amino]-5-methoxy-2-methyl-phenyl]azo-2,5-dimethoxy-phenyl]azo-5-methoxy-2-methyl-phenyl]azonaphthalene-1,6-disulfonic acid CAS Name: 8-[4-[4-[4-[[(4-aminophenyl)-oxomethyl]amino]-5-methoxy-2-methylphenyl]azo-2,5-dimethoxyphenyl]azo-5-methoxy-2-methylphenyl]azonaphthalene-1,6-disulfonic acid IUPAC Name: 8-[[4-[[4-[[4-[(4-aminobenzoyl)amino]-5-methoxy-2-methylphenyl]diazenyl]-2,5-dimethoxyphenyl]diazenyl]-5-methoxy-2-methylphenyl]diazenyl]naphthalene-1,6-disulfonic acid Traditional Name: 8-[4-[4-[4-[(4-aminobenzoyl)amino]-5-methoxy-2-methyl-phenyl]azo-2,5-dimethoxy-phenyl]azo-5-methoxy-2-methyl-phenyl]azonaphthalene-1,6-disulfonic acid Formula: C41H38N8O11S2 MolecularWeight: 882.91742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N=NC2=C(C=C(C(=C2)OC)N=NC3=C(C=C(C(=C3)C)N=NC4=C5C(=CC(=C4)S(=O)(=O)O)C=CC=C5S(=O)(=O)O)OC)OC)OC)NC(=O)C6=CC=C(C=C6)N

Isomeric SMILES

CC1=CC(=C(C=C1N=NC2=C(C=C(C(=C2)OC)N=NC3=C(C=C(C(=C3)C)N=NC4=C5C(=CC(=C4)S(=O)(=O)O)C=CC=C5S(=O)(=O)O)OC)OC)OC)NC(=O)C6=CC=C(C=C6)N

InChI

InChI=1S/C41H38N8O11S2/c1-22-14-30(43-41(50)24-10-12-26(42)13-11-24)35(57-3)18-28(22)44-47-32-20-38(60-6)33(21-37(32)59-5)48-46-31-15-23(2)29(19-36(31)58-4)45-49-34-17-27(61(51,52)53)16-25-8-7-9-39(40(25)34)62(54,55)56/h7-21H,42H2,1-6H3,(H,43,50)(H,51,52,53)(H,54,55,56)