(2-chloranyl-4-methyl-phenyl) 3,4-bis(azanyl)benzenesulfonate

Systemtic Name: (2-chloranyl-4-methyl-phenyl) 3,4-bis(azanyl)benzenesulfonate Openeye Name: (2-chloro-4-methyl-phenyl) 3,4-diaminobenzenesulfonate CAS Name: 3,4-diaminobenzenesulfonic acid (2-chloro-4-methylphenyl) ester IUPAC Name: (2-chloro-4-methylphenyl) 3,4-diaminobenzenesulfonate Traditional Name: 3,4-diaminobenzenesulfonic acid (2-chloro-4-methyl-phenyl) ester Formula: C13H13ClN2O3S MolecularWeight: 312.77192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC(=C(C=C2)N)N)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC(=C(C=C2)N)N)Cl

InChI

InChI=1S/C13H13ClN2O3S/c1-8-2-5-13(10(14)6-8)19-20(17,18)9-3-4-11(15)12(16)7-9/h2-7H,15-16H2,1H3