4-[3-(4-chloranylphenoxy)propylamino]-4-oxidanylidene-2-propan-2-yl-butanoic acid

Systemtic Name: 4-[3-(4-chloranylphenoxy)propylamino]-4-oxidanylidene-2-propan-2-yl-butanoic acid Openeye Name: 4-[3-(4-chlorophenoxy)propylamino]-2-isopropyl-4-oxo-butanoic acid CAS Name: 4-[3-(4-chlorophenoxy)propylamino]-4-oxo-2-propan-2-ylbutanoic acid IUPAC Name: 4-[3-(4-chlorophenoxy)propylamino]-4-oxo-2-propan-2-ylbutanoic acid Traditional Name: 4-[3-(4-chlorophenoxy)propylamino]-2-isopropyl-4-keto-butyric acid Formula: C16H22ClNO4 MolecularWeight: 327.80318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)NCCCOC1=CC=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CC(C)C(CC(=O)NCCCOC1=CC=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C16H22ClNO4/c1-11(2)14(16(20)21)10-15(19)18-8-3-9-22-13-6-4-12(17)5-7-13/h4-7,11,14H,3,8-10H2,1-2H3,(H,18,19)(H,20,21)