methyl 4-(2-oxidanylidenepropyl)benzoate

Systemtic Name: methyl 4-(2-oxidanylidenepropyl)benzoate Openeye Name: methyl 4-acetonylbenzoate CAS Name: 4-(2-oxopropyl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-oxopropyl)benzoate Traditional Name: 4-acetonylbenzoic acid methyl ester Formula: C11H12O3 MolecularWeight: 192.21118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O3/c1-8(12)7-9-3-5-10(6-4-9)11(13)14-2/h3-6H,7H2,1-2H3