methyl (6S)-6-phenylcyclohexa-1,4-diene-1-carboxylate

Systemtic Name: methyl (6S)-6-phenylcyclohexa-1,4-diene-1-carboxylate Openeye Name: methyl (6S)-6-phenylcyclohexa-1,4-diene-1-carboxylate CAS Name: (6S)-6-phenyl-1-cyclohexa-1,4-dienecarboxylic acid methyl ester IUPAC Name: methyl (6S)-6-phenylcyclohexa-1,4-diene-1-carboxylate Traditional Name: (6S)-6-phenylcyclohexa-1,4-diene-1-carboxylic acid methyl ester Formula: C14H14O2 MolecularWeight: 214.25976

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CCC=CC1C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CCC=C[C@H]1C2=CC=CC=C2

InChI

InChI=1S/C14H14O2/c1-16-14(15)13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-5,7-10,12H,6H2,1H3/t12-/m0/s1