ethyl 2-oxidanylidene-3-phenyl-cycloheptane-1-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-3-phenyl-cycloheptane-1-carboxylate Openeye Name: ethyl 2-oxo-3-phenyl-cycloheptanecarboxylate CAS Name: 2-oxo-3-phenyl-1-cycloheptanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-oxo-3-phenylcycloheptane-1-carboxylate Traditional Name: 2-keto-3-phenyl-cycloheptanecarboxylic acid ethyl ester Formula: C16H20O3 MolecularWeight: 260.3282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCC(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCCCC(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20O3/c1-2-19-16(18)14-11-7-6-10-13(15(14)17)12-8-4-3-5-9-12/h3-5,8-9,13-14H,2,6-7,10-11H2,1H3