2-[4-[chloranyl(phenyl)amino]-4-oxidanylidene-butan-2-yl]hexanoic acid

Systemtic Name: 2-[4-[chloranyl(phenyl)amino]-4-oxidanylidene-butan-2-yl]hexanoic acid Openeye Name: 2-[3-(N-chloroanilino)-1-methyl-3-oxo-propyl]hexanoic acid CAS Name: 2-[4-(N-chloroanilino)-4-oxobutan-2-yl]hexanoic acid IUPAC Name: 2-[4-(N-chloroanilino)-4-oxobutan-2-yl]hexanoic acid Traditional Name: 2-[3-(N-chloroanilino)-3-keto-1-methyl-propyl]hexanoic acid Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)CC(=O)N(C1=CC=CC=C1)Cl)C(=O)O

Isomeric SMILES

CCCCC(C(C)CC(=O)N(C1=CC=CC=C1)Cl)C(=O)O

InChI

InChI=1S/C16H22ClNO3/c1-3-4-10-14(16(20)21)12(2)11-15(19)18(17)13-8-6-5-7-9-13/h5-9,12,14H,3-4,10-11H2,1-2H3,(H,20,21)