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

Systemtic Name: 3-[(3-chloranyl-4-methyl-phenyl)amino]propanoic acid Openeye Name: 3-(3-chloro-4-methyl-anilino)propanoic acid CAS Name: 3-(3-chloro-4-methylanilino)propanoic acid IUPAC Name: 3-(3-chloro-4-methylanilino)propanoic acid Traditional Name: 3-(3-chloro-4-methyl-anilino)propionic acid Formula: C10H12ClNO2 MolecularWeight: 213.66078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H12ClNO2/c1-7-2-3-8(6-9(7)11)12-5-4-10(13)14/h2-3,6,12H,4-5H2,1H3,(H,13,14)