5-[(2-ethyl-6-methyl-phenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(2-ethyl-6-methyl-phenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(2-ethyl-6-methyl-anilino)-5-oxo-pentanoic acid CAS Name: 5-(2-ethyl-6-methylanilino)-5-oxopentanoic acid IUPAC Name: 5-(2-ethyl-6-methylanilino)-5-oxopentanoic acid Traditional Name: 5-(2-ethyl-6-methyl-anilino)-5-keto-valeric acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CCCC(=O)O)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CCCC(=O)O)C

InChI

InChI=1S/C14H19NO3/c1-3-11-7-4-6-10(2)14(11)15-12(16)8-5-9-13(17)18/h4,6-7H,3,5,8-9H2,1-2H3,(H,15,16)(H,17,18)