sodium 4-[[2,4-bis(azanyl)-5-methyl-phenyl]diazenyl]benzenesulfonic acid

Systemtic Name: sodium 4-[[2,4-bis(azanyl)-5-methyl-phenyl]diazenyl]benzenesulfonic acid Openeye Name: sodium 4-(2,4-diamino-5-methyl-phenyl)azobenzenesulfonic acid CAS Name: sodium 4-(2,4-diamino-5-methylphenyl)azobenzenesulfonic acid IUPAC Name: sodium 4-[(2,4-diamino-5-methylphenyl)diazenyl]benzenesulfonic acid Traditional Name: sodium 4-(2,4-diamino-5-methyl-phenyl)azobesylic acid Formula: C13H14N4NaO3S+ MolecularWeight: 329.33003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N4O3S.Na/c1-8-6-13(12(15)7-11(8)14)17-16-9-2-4-10(5-3-9)21(18,19)20;/h2-7H,14-15H2,1H3,(H,18,19,20);/q;+1