ethyl 3-[(E)-4-butoxycarbonyl-5-oxidanylidene-hex-1-enyl]benzoate

Systemtic Name: ethyl 3-[(E)-4-butoxycarbonyl-5-oxidanylidene-hex-1-enyl]benzoate Openeye Name: ethyl 3-[(E)-4-butoxycarbonyl-5-oxo-hex-1-enyl]benzoate CAS Name: 3-[(E)-4-[butoxy(oxo)methyl]-5-oxohex-1-enyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(E)-4-butoxycarbonyl-5-oxohex-1-enyl]benzoate Traditional Name: 3-[(E)-4-butoxycarbonyl-5-keto-hex-1-enyl]benzoic acid ethyl ester Formula: C20H26O5 MolecularWeight: 346.41744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC=CC1=CC(=CC=C1)C(=O)OCC)C(=O)C

Isomeric SMILES

CCCCOC(=O)C(C/C=C/C1=CC(=CC=C1)C(=O)OCC)C(=O)C

InChI

InChI=1S/C20H26O5/c1-4-6-13-25-20(23)18(15(3)21)12-8-10-16-9-7-11-17(14-16)19(22)24-5-2/h7-11,14,18H,4-6,12-13H2,1-3H3/b10-8+