dimethyl 2-[(E)-6-oxidanylidene-6-phenyl-hex-2-enyl]propanedioate

Systemtic Name: dimethyl 2-[(E)-6-oxidanylidene-6-phenyl-hex-2-enyl]propanedioate Openeye Name: dimethyl 2-[(E)-6-oxo-6-phenyl-hex-2-enyl]propanedioate CAS Name: 2-[(E)-6-oxo-6-phenylhex-2-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(E)-6-oxo-6-phenylhex-2-enyl]propanedioate Traditional Name: 2-[(E)-6-keto-6-phenyl-hex-2-enyl]malonic acid dimethyl ester Formula: C17H20O5 MolecularWeight: 304.3377

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC=CCCC(=O)C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C(C/C=C/CCC(=O)C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C17H20O5/c1-21-16(19)14(17(20)22-2)11-7-4-8-12-15(18)13-9-5-3-6-10-13/h3-7,9-10,14H,8,11-12H2,1-2H3/b7-4+