2-[4-[(2-chlorophenyl)amino]-4-oxidanylidene-butan-2-yl]hexanoate

Systemtic Name: 2-[4-[(2-chlorophenyl)amino]-4-oxidanylidene-butan-2-yl]hexanoate Openeye Name: 2-[3-(2-chloroanilino)-1-methyl-3-oxo-propyl]hexanoate CAS Name: 2-[4-(2-chloroanilino)-4-oxobutan-2-yl]hexanoate IUPAC Name: 2-[4-(2-chloroanilino)-4-oxobutan-2-yl]hexanoate Traditional Name: 2-[3-(2-chloroanilino)-3-keto-1-methyl-propyl]hexanoate Formula: C16H21ClNO3- MolecularWeight: 310.79584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)CC(=O)NC1=CC=CC=C1Cl)C(=O)[O-]

Isomeric SMILES

CCCCC(C(C)CC(=O)NC1=CC=CC=C1Cl)C(=O)[O-]

InChI

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