methyl 4-[(E)-4-chloranyl-4-oxidanylidene-but-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-4-chloranyl-4-oxidanylidene-but-1-enyl]benzoate Openeye Name: methyl 4-[(E)-4-chloro-4-oxo-but-1-enyl]benzoate CAS Name: 4-[(E)-4-chloro-4-oxobut-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-4-chloro-4-oxobut-1-enyl]benzoate Traditional Name: 4-[(E)-4-chloro-4-keto-but-1-enyl]benzoic acid methyl ester Formula: C12H11ClO3 MolecularWeight: 238.66694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=CCC(=O)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C/CC(=O)Cl

InChI

InChI=1S/C12H11ClO3/c1-16-12(15)10-7-5-9(6-8-10)3-2-4-11(13)14/h2-3,5-8H,4H2,1H3/b3-2+