disodium 4-[[5-methoxy-2-methyl-4-[(4-oxidanidylphenyl)diazenyl]phenyl]diazenyl]benzenesulfonate

Systemtic Name: disodium 4-[[5-methoxy-2-methyl-4-[(4-oxidanidylphenyl)diazenyl]phenyl]diazenyl]benzenesulfonate Openeye Name: disodium 4-[5-methoxy-2-methyl-4-(4-oxidophenyl)azo-phenyl]azobenzenesulfonate CAS Name: disodium 4-[5-methoxy-2-methyl-4-(4-oxidophenyl)azophenyl]azobenzenesulfonate IUPAC Name: disodium 4-[[5-methoxy-2-methyl-4-[(4-oxidophenyl)diazenyl]phenyl]diazenyl]benzenesulfonate Traditional Name: disodium 4-[5-methoxy-2-methyl-4-(4-oxidophenyl)azo-phenyl]azobesylate Formula: C20H16N4Na2O5S MolecularWeight: 470.40938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])OC)N=NC3=CC=C(C=C3)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC(=C(C=C1N=NC2=CC=C(C=C2)S(=O)(=O)[O-])OC)N=NC3=CC=C(C=C3)[O-].[Na+].[Na+]

InChI

InChI=1S/C20H18N4O5S.2Na/c1-13-11-19(24-22-14-3-7-16(25)8-4-14)20(29-2)12-18(13)23-21-15-5-9-17(10-6-15)30(26,27)28;;/h3-12,25H,1-2H3,(H,26,27,28);;/q;2*+1/p-2