5-[(2,6-dimethylphenyl)amino]pentanoic acid

Systemtic Name: 5-[(2,6-dimethylphenyl)amino]pentanoic acid Openeye Name: 5-(2,6-dimethylanilino)pentanoic acid CAS Name: 5-(2,6-dimethylanilino)pentanoic acid IUPAC Name: 5-(2,6-dimethylanilino)pentanoic acid Traditional Name: 5-(2,6-dimethylanilino)valeric acid Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2/c1-10-6-5-7-11(2)13(10)14-9-4-3-8-12(15)16/h5-7,14H,3-4,8-9H2,1-2H3,(H,15,16)