5-[(2-methylphenyl)methylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(2-methylphenyl)methylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-(o-tolylmethylamino)-5-oxo-pentanoic acid CAS Name: 5-[(2-methylphenyl)methylamino]-5-oxopentanoic acid IUPAC Name: 5-[(2-methylphenyl)methylamino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[(2-methylbenzyl)amino]valeric acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)CCCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)CCCC(=O)O

InChI

InChI=1S/C13H17NO3/c1-10-5-2-3-6-11(10)9-14-12(15)7-4-8-13(16)17/h2-3,5-6H,4,7-9H2,1H3,(H,14,15)(H,16,17)