7-[(2,6-dimethylphenyl)-ethyl-amino]heptanoic acid

Systemtic Name: 7-[(2,6-dimethylphenyl)-ethyl-amino]heptanoic acid Openeye Name: 7-(N-ethyl-2,6-dimethyl-anilino)heptanoic acid CAS Name: 7-(N-ethyl-2,6-dimethylanilino)heptanoic acid IUPAC Name: 7-(N-ethyl-2,6-dimethylanilino)heptanoic acid Traditional Name: 7-(N-ethyl-2,6-dimethyl-anilino)enanthic acid Formula: C17H27NO2 MolecularWeight: 277.40178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCCCCC(=O)O)C1=C(C=CC=C1C)C

Isomeric SMILES

CCN(CCCCCCC(=O)O)C1=C(C=CC=C1C)C

InChI

InChI=1S/C17H27NO2/c1-4-18(13-8-6-5-7-12-16(19)20)17-14(2)10-9-11-15(17)3/h9-11H,4-8,12-13H2,1-3H3,(H,19,20)