ethyl 4-(2-methyl-3-oxidanylidene-propyl)benzoate

Systemtic Name: ethyl 4-(2-methyl-3-oxidanylidene-propyl)benzoate Openeye Name: ethyl 4-(2-methyl-3-oxo-propyl)benzoate CAS Name: 4-(2-methyl-3-oxopropyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-methyl-3-oxopropyl)benzoate Traditional Name: 4-(3-keto-2-methyl-propyl)benzoic acid ethyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3/c1-3-16-13(15)12-6-4-11(5-7-12)8-10(2)9-14/h4-7,9-10H,3,8H2,1-2H3