8-[(2-chloranyl-5-methyl-phenyl)carbonylamino]octanoic acid

Systemtic Name: 8-[(2-chloranyl-5-methyl-phenyl)carbonylamino]octanoic acid Openeye Name: 8-[(2-chloro-5-methyl-benzoyl)amino]octanoic acid CAS Name: 8-[[(2-chloro-5-methylphenyl)-oxomethyl]amino]octanoic acid IUPAC Name: 8-[(2-chloro-5-methylbenzoyl)amino]octanoic acid Traditional Name: 8-[(2-chloro-5-methyl-benzoyl)amino]caprylic acid Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)C(=O)NCCCCCCCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)C(=O)NCCCCCCCC(=O)O

InChI

InChI=1S/C16H22ClNO3/c1-12-8-9-14(17)13(11-12)16(21)18-10-6-4-2-3-5-7-15(19)20/h8-9,11H,2-7,10H2,1H3,(H,18,21)(H,19,20)