[3,4-bis(azanyl)phenyl] 5-chloranyl-2-methyl-benzenesulfonate

Systemtic Name: [3,4-bis(azanyl)phenyl] 5-chloranyl-2-methyl-benzenesulfonate Openeye Name: (3,4-diaminophenyl) 5-chloro-2-methyl-benzenesulfonate CAS Name: 5-chloro-2-methylbenzenesulfonic acid (3,4-diaminophenyl) ester IUPAC Name: (3,4-diaminophenyl) 5-chloro-2-methylbenzenesulfonate Traditional Name: 5-chloro-2-methyl-benzenesulfonic acid (3,4-diaminophenyl) ester Formula: C13H13ClN2O3S MolecularWeight: 312.77192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)S(=O)(=O)OC2=CC(=C(C=C2)N)N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)S(=O)(=O)OC2=CC(=C(C=C2)N)N

InChI

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