disodium 8-[(4-azanyl-2,5-dimethoxy-phenyl)diazenyl]-5-[(3-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate

Systemtic Name: disodium 8-[(4-azanyl-2,5-dimethoxy-phenyl)diazenyl]-5-[(3-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate Openeye Name: disodium 8-(4-amino-2,5-dimethoxy-phenyl)azo-5-(3-sulfonatophenyl)azo-naphthalene-2-sulfonate CAS Name: disodium 8-(4-amino-2,5-dimethoxyphenyl)azo-5-(3-sulfonatophenyl)azo-2-naphthalenesulfonate IUPAC Name: disodium 8-[(4-amino-2,5-dimethoxyphenyl)diazenyl]-5-[(3-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate Traditional Name: disodium 8-(4-amino-2,5-dimethoxy-phenyl)azo-5-(3-sulfonatophenyl)azo-naphthalene-2-sulfonate Formula: C24H19N5Na2O8S2 MolecularWeight: 615.5459

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+].[Na+]

Isomeric SMILES

COC1=CC(=C(C=C1N=NC2=C3C=C(C=CC3=C(C=C2)N=NC4=CC(=CC=C4)S(=O)(=O)[O-])S(=O)(=O)[O-])OC)N.[Na+].[Na+]

InChI

InChI=1S/C24H21N5O8S2.2Na/c1-36-23-13-22(24(37-2)12-19(23)25)29-28-21-9-8-20(17-7-6-16(11-18(17)21)39(33,34)35)27-26-14-4-3-5-15(10-14)38(30,31)32;;/h3-13H,25H2,1-2H3,(H,30,31,32)(H,33,34,35);;/q;2*+1/p-2