6-[(3-chloranyl-2-methyl-phenyl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(3-chloranyl-2-methyl-phenyl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-(3-chloro-2-methyl-anilino)-6-oxo-hexanoic acid CAS Name: 6-(3-chloro-2-methylanilino)-6-oxohexanoic acid IUPAC Name: 6-(3-chloro-2-methylanilino)-6-oxohexanoic acid Traditional Name: 6-(3-chloro-2-methyl-anilino)-6-keto-hexanoic acid Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CCCCC(=O)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C13H16ClNO3/c1-9-10(14)5-4-6-11(9)15-12(16)7-2-3-8-13(17)18/h4-6H,2-3,7-8H2,1H3,(H,15,16)(H,17,18)