4-[[2,6-bis(azanyl)-3-methyl-phenyl]diazenyl]benzenesulfonic acid

Systemtic Name: 4-[[2,6-bis(azanyl)-3-methyl-phenyl]diazenyl]benzenesulfonic acid Openeye Name: 4-(2,6-diamino-3-methyl-phenyl)azobenzenesulfonic acid CAS Name: 4-(2,6-diamino-3-methylphenyl)azobenzenesulfonic acid IUPAC Name: 4-[(2,6-diamino-3-methylphenyl)diazenyl]benzenesulfonic acid Traditional Name: 4-(2,6-diamino-3-methyl-phenyl)azobesylic acid Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)N)N=NC2=CC=C(C=C2)S(=O)(=O)O)N

Isomeric SMILES

CC1=C(C(=C(C=C1)N)N=NC2=CC=C(C=C2)S(=O)(=O)O)N

InChI

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