1-[(5-chloranyl-2-methyl-phenyl)amino]ethanesulfonic acid

Systemtic Name: 1-[(5-chloranyl-2-methyl-phenyl)amino]ethanesulfonic acid Openeye Name: 1-(5-chloro-2-methyl-anilino)ethanesulfonic acid CAS Name: 1-(5-chloro-2-methylanilino)ethanesulfonic acid IUPAC Name: 1-(5-chloro-2-methylanilino)ethanesulfonic acid Traditional Name: 1-(5-chloro-2-methyl-anilino)ethanesulfonic acid Formula: C9H12ClNO3S MolecularWeight: 249.71448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(C)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(C)S(=O)(=O)O

InChI

InChI=1S/C9H12ClNO3S/c1-6-3-4-8(10)5-9(6)11-7(2)15(12,13)14/h3-5,7,11H,1-2H3,(H,12,13,14)