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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2/c1-10-6-7-11(2)12(9-10)14-8-4-3-5-13(15)16/h6-7,9,14H,3-5,8H2,1-2H3,(H,15,16)