(3S)-3-(4-chlorophenyl)-5-ethoxy-5-oxidanylidene-pentanoic acid

Systemtic Name: (3S)-3-(4-chlorophenyl)-5-ethoxy-5-oxidanylidene-pentanoic acid Openeye Name: (3S)-3-(4-chlorophenyl)-5-ethoxy-5-oxo-pentanoic acid CAS Name: (3S)-3-(4-chlorophenyl)-5-ethoxy-5-oxopentanoic acid IUPAC Name: (3S)-3-(4-chlorophenyl)-5-ethoxy-5-oxopentanoic acid Traditional Name: (3S)-3-(4-chlorophenyl)-5-ethoxy-5-keto-valeric acid Formula: C13H15ClO4 MolecularWeight: 270.7088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C[C@H](CC(=O)O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H15ClO4/c1-2-18-13(17)8-10(7-12(15)16)9-3-5-11(14)6-4-9/h3-6,10H,2,7-8H2,1H3,(H,15,16)/t10-/m0/s1