methyl 3-chloranyl-4-(2-oxidanylidenepropyl)benzoate

Systemtic Name: methyl 3-chloranyl-4-(2-oxidanylidenepropyl)benzoate Openeye Name: methyl 4-acetonyl-3-chloro-benzoate CAS Name: 3-chloro-4-(2-oxopropyl)benzoic acid methyl ester IUPAC Name: methyl 3-chloro-4-(2-oxopropyl)benzoate Traditional Name: 4-acetonyl-3-chloro-benzoic acid methyl ester Formula: C11H11ClO3 MolecularWeight: 226.65624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C=C(C=C1)C(=O)OC)Cl

Isomeric SMILES

CC(=O)CC1=C(C=C(C=C1)C(=O)OC)Cl

InChI

InChI=1S/C11H11ClO3/c1-7(13)5-8-3-4-9(6-10(8)12)11(14)15-2/h3-4,6H,5H2,1-2H3