2-[[2-(4-chloranyl-3-methyl-phenyl)-2-oxidanylidene-ethyl]-methyl-azaniumyl]ethanoate

Systemtic Name: 2-[[2-(4-chloranyl-3-methyl-phenyl)-2-oxidanylidene-ethyl]-methyl-azaniumyl]ethanoate Openeye Name: 2-[[2-(4-chloro-3-methyl-phenyl)-2-oxo-ethyl]-methyl-ammonio]acetate CAS Name: 2-[[2-(4-chloro-3-methylphenyl)-2-oxoethyl]-methylammonio]acetate IUPAC Name: 2-[[2-(4-chloro-3-methylphenyl)-2-oxoethyl]-methylazaniumyl]acetate Traditional Name: 2-[[2-(4-chloro-3-methyl-phenyl)-2-keto-ethyl]-methyl-ammonio]acetate Formula: C12H14ClNO3 MolecularWeight: 255.69746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C[NH+](C)CC(=O)[O-])Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C[NH+](C)CC(=O)[O-])Cl

InChI

InChI=1S/C12H14ClNO3/c1-8-5-9(3-4-10(8)13)11(15)6-14(2)7-12(16)17/h3-5H,6-7H2,1-2H3,(H,16,17)