sodium 4-methoxy-3-[[4-[(4-methoxyphenyl)diazenyl]phenyl]diazenyl]benzenesulfonate

Systemtic Name: sodium 4-methoxy-3-[[4-[(4-methoxyphenyl)diazenyl]phenyl]diazenyl]benzenesulfonate Openeye Name: sodium 4-methoxy-3-[4-(4-methoxyphenyl)azophenyl]azo-benzenesulfonate CAS Name: sodium 4-methoxy-3-[4-(4-methoxyphenyl)azophenyl]azobenzenesulfonate IUPAC Name: sodium 4-methoxy-3-[[4-[(4-methoxyphenyl)diazenyl]phenyl]diazenyl]benzenesulfonate Traditional Name: sodium 4-methoxy-3-[4-(4-methoxyphenyl)azophenyl]azo-besylate Formula: C20H17N4NaO5S MolecularWeight: 448.42755

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])OC.[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])OC.[Na+]

InChI

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