8-[(2-methylphenyl)amino]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[(2-methylphenyl)amino]-8-oxidanylidene-octanoic acid Openeye Name: 8-(2-methylanilino)-8-oxo-octanoic acid CAS Name: 8-(2-methylanilino)-8-oxooctanoic acid IUPAC Name: 8-(2-methylanilino)-8-oxooctanoic acid Traditional Name: 8-keto-8-(o-toluidino)caprylic acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCCCCCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCCCCCC(=O)O

InChI

InChI=1S/C15H21NO3/c1-12-8-6-7-9-13(12)16-14(17)10-4-2-3-5-11-15(18)19/h6-9H,2-5,10-11H2,1H3,(H,16,17)(H,18,19)