8-[(3-methyl-2-oxidanyl-phenyl)carbonylamino]octanoic acid

Systemtic Name: 8-[(3-methyl-2-oxidanyl-phenyl)carbonylamino]octanoic acid Openeye Name: 8-[(2-hydroxy-3-methyl-benzoyl)amino]octanoic acid CAS Name: 8-[[(2-hydroxy-3-methylphenyl)-oxomethyl]amino]octanoic acid IUPAC Name: 8-[(2-hydroxy-3-methylbenzoyl)amino]octanoic acid Traditional Name: 8-[(2-hydroxy-3-methyl-benzoyl)amino]caprylic acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)NCCCCCCCC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)NCCCCCCCC(=O)O

InChI

InChI=1S/C16H23NO4/c1-12-8-7-9-13(15(12)20)16(21)17-11-6-4-2-3-5-10-14(18)19/h7-9,20H,2-6,10-11H2,1H3,(H,17,21)(H,18,19)