6-[(4-methylphenyl)methylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(4-methylphenyl)methylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-oxo-6-(p-tolylmethylamino)hexanoic acid CAS Name: 6-[(4-methylphenyl)methylamino]-6-oxohexanoic acid IUPAC Name: 6-[(4-methylphenyl)methylamino]-6-oxohexanoic acid Traditional Name: 6-keto-6-[(4-methylbenzyl)amino]hexanoic acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CCCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CCCCC(=O)O

InChI

InChI=1S/C14H19NO3/c1-11-6-8-12(9-7-11)10-15-13(16)4-2-3-5-14(17)18/h6-9H,2-5,10H2,1H3,(H,15,16)(H,17,18)