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

Systemtic Name: 5-[(5-chloranyl-2-methyl-phenyl)amino]pentanoic acid Openeye Name: 5-(5-chloro-2-methyl-anilino)pentanoic acid CAS Name: 5-(5-chloro-2-methylanilino)pentanoic acid IUPAC Name: 5-(5-chloro-2-methylanilino)pentanoic acid Traditional Name: 5-(5-chloro-2-methyl-anilino)valeric acid Formula: C12H16ClNO2 MolecularWeight: 241.71394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClNO2/c1-9-5-6-10(13)8-11(9)14-7-3-2-4-12(15)16/h5-6,8,14H,2-4,7H2,1H3,(H,15,16)