ethyl (1S,2E)-2-(phenylmethylidene)cycloheptane-1-carboxylate

Systemtic Name: ethyl (1S,2E)-2-(phenylmethylidene)cycloheptane-1-carboxylate Openeye Name: ethyl (1S,2E)-2-benzylidenecycloheptanecarboxylate CAS Name: (1S,2E)-2-(phenylmethylene)-1-cycloheptanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2E)-2-benzylidenecycloheptane-1-carboxylate Traditional Name: (1S,2E)-2-benzalcycloheptanecarboxylic acid ethyl ester Formula: C17H22O2 MolecularWeight: 258.35538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCCC1=CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H]\1CCCCC/C1=C\C2=CC=CC=C2

InChI

InChI=1S/C17H22O2/c1-2-19-17(18)16-12-8-4-7-11-15(16)13-14-9-5-3-6-10-14/h3,5-6,9-10,13,16H,2,4,7-8,11-12H2,1H3/b15-13+/t16-/m0/s1