3-[(3-chloranyl-4-methyl-phenyl)amino]-2-methyl-propanoic acid

Systemtic Name: 3-[(3-chloranyl-4-methyl-phenyl)amino]-2-methyl-propanoic acid Openeye Name: 3-(3-chloro-4-methyl-anilino)-2-methyl-propanoic acid CAS Name: 3-(3-chloro-4-methylanilino)-2-methylpropanoic acid IUPAC Name: 3-(3-chloro-4-methylanilino)-2-methylpropanoic acid Traditional Name: 3-(3-chloro-4-methyl-anilino)-2-methyl-propionic acid Formula: C11H14ClNO2 MolecularWeight: 227.68736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC(C)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NCC(C)C(=O)O)Cl

InChI

InChI=1S/C11H14ClNO2/c1-7-3-4-9(5-10(7)12)13-6-8(2)11(14)15/h3-5,8,13H,6H2,1-2H3,(H,14,15)