3-[(2-chlorophenyl)methyl]-5-oxidanylidene-pentanoate

Systemtic Name: 3-[(2-chlorophenyl)methyl]-5-oxidanylidene-pentanoate Openeye Name: 3-[(2-chlorophenyl)methyl]-5-oxo-pentanoate CAS Name: 3-[(2-chlorophenyl)methyl]-5-oxopentanoate IUPAC Name: 3-[(2-chlorophenyl)methyl]-5-oxopentanoate Traditional Name: 3-(2-chlorobenzyl)-5-keto-valerate Formula: C12H12ClO3- MolecularWeight: 239.67488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(CC=O)CC(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)CC(CC=O)CC(=O)[O-])Cl

InChI

InChI=1S/C12H13ClO3/c13-11-4-2-1-3-10(11)7-9(5-6-14)8-12(15)16/h1-4,6,9H,5,7-8H2,(H,15,16)/p-1