methyl 4-chloranyl-2-(3-methoxy-3-oxidanylidene-propyl)benzoate

Systemtic Name: methyl 4-chloranyl-2-(3-methoxy-3-oxidanylidene-propyl)benzoate Openeye Name: methyl 4-chloro-2-(3-methoxy-3-oxo-propyl)benzoate CAS Name: 4-chloro-2-(3-methoxy-3-oxopropyl)benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-(3-methoxy-3-oxopropyl)benzoate Traditional Name: 4-chloro-2-(3-keto-3-methoxy-propyl)benzoic acid methyl ester Formula: C12H13ClO4 MolecularWeight: 256.68222

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=C(C=CC(=C1)Cl)C(=O)OC

Isomeric SMILES

COC(=O)CCC1=C(C=CC(=C1)Cl)C(=O)OC

InChI

InChI=1S/C12H13ClO4/c1-16-11(14)6-3-8-7-9(13)4-5-10(8)12(15)17-2/h4-5,7H,3,6H2,1-2H3