dimethyl 2-(3-phenylcyclohex-2-en-1-yl)propanedioate

Systemtic Name: dimethyl 2-(3-phenylcyclohex-2-en-1-yl)propanedioate Openeye Name: dimethyl 2-(3-phenylcyclohex-2-en-1-yl)propanedioate CAS Name: 2-(3-phenyl-1-cyclohex-2-enyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(3-phenylcyclohex-2-en-1-yl)propanedioate Traditional Name: 2-(3-phenylcyclohex-2-en-1-yl)malonic acid dimethyl ester Formula: C17H20O4 MolecularWeight: 288.3383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCCC(=C1)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C(C1CCCC(=C1)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H20O4/c1-20-16(18)15(17(19)21-2)14-10-6-9-13(11-14)12-7-4-3-5-8-12/h3-5,7-8,11,14-15H,6,9-10H2,1-2H3