dimethyl (2R,6S)-1-cyano-6-phenyl-cyclohex-4-ene-1,2-dicarboxylate

Systemtic Name: dimethyl (2R,6S)-1-cyano-6-phenyl-cyclohex-4-ene-1,2-dicarboxylate Openeye Name: dimethyl (2R,6S)-1-cyano-6-phenyl-cyclohex-4-ene-1,2-dicarboxylate CAS Name: (2R,6S)-1-cyano-6-phenylcyclohex-4-ene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,6S)-1-cyano-6-phenylcyclohex-4-ene-1,2-dicarboxylate Traditional Name: (2R,6S)-1-cyano-6-phenyl-cyclohex-4-ene-1,2-dicarboxylic acid dimethyl ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=CC(C1(C#N)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1CC=C[C@H](C1(C#N)C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C17H17NO4/c1-21-15(19)14-10-6-9-13(12-7-4-3-5-8-12)17(14,11-18)16(20)22-2/h3-9,13-14H,10H2,1-2H3/t13-,14-,17?/m0/s1