8-[(2,6-dimethylphenyl)amino]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[(2,6-dimethylphenyl)amino]-8-oxidanylidene-octanoic acid Openeye Name: 8-(2,6-dimethylanilino)-8-oxo-octanoic acid CAS Name: 8-(2,6-dimethylanilino)-8-oxooctanoic acid IUPAC Name: 8-(2,6-dimethylanilino)-8-oxooctanoic acid Traditional Name: 8-(2,6-dimethylanilino)-8-keto-caprylic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCCCCC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCCCCC(=O)O

InChI

InChI=1S/C16H23NO3/c1-12-8-7-9-13(2)16(12)17-14(18)10-5-3-4-6-11-15(19)20/h7-9H,3-6,10-11H2,1-2H3,(H,17,18)(H,19,20)