butyl 5-oxidanylidene-3-phenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: butyl 5-oxidanylidene-3-phenyl-cyclohex-3-ene-1-carboxylate Openeye Name: butyl 5-oxo-3-phenyl-cyclohex-3-ene-1-carboxylate CAS Name: 5-oxo-3-phenyl-1-cyclohex-3-enecarboxylic acid butyl ester IUPAC Name: butyl 5-oxo-3-phenylcyclohex-3-ene-1-carboxylate Traditional Name: 5-keto-3-phenyl-cyclohex-3-ene-1-carboxylic acid butyl ester Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CC(=CC(=O)C1)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)C1CC(=CC(=O)C1)C2=CC=CC=C2

InChI

InChI=1S/C17H20O3/c1-2-3-9-20-17(19)15-10-14(11-16(18)12-15)13-7-5-4-6-8-13/h4-8,11,15H,2-3,9-10,12H2,1H3