sodium 2-[[(4-chloranyl-2-methyl-phenyl)diazenyl]-methyl-amino]ethanesulfonate

Systemtic Name: sodium 2-[[(4-chloranyl-2-methyl-phenyl)diazenyl]-methyl-amino]ethanesulfonate Openeye Name: sodium 2-[(4-chloro-2-methyl-phenyl)azo-methyl-amino]ethanesulfonate CAS Name: sodium 2-[(4-chloro-2-methylphenyl)azo-methylamino]ethanesulfonate IUPAC Name: sodium 2-[[(4-chloro-2-methylphenyl)diazenyl]-methylamino]ethanesulfonate Traditional Name: sodium 2-[(4-chloro-2-methyl-phenyl)azo-methyl-amino]ethanesulfonate Formula: C10H13ClN3NaO3S MolecularWeight: 313.73629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)N=NN(C)CCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)N=NN(C)CCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C10H14ClN3O3S.Na/c1-8-7-9(11)3-4-10(8)12-13-14(2)5-6-18(15,16)17;/h3-4,7H,5-6H2,1-2H3,(H,15,16,17);/q;+1/p-1