O1-ethyl O3-[1-(2-phenylethynyl)cyclohexyl] propanedioate

Systemtic Name: O1-ethyl O3-[1-(2-phenylethynyl)cyclohexyl] propanedioate Openeye Name: O1-ethyl O3-[1-(2-phenylethynyl)cyclohexyl] propanedioate CAS Name: propanedioic acid O1-ethyl ester O3-[1-(2-phenylethynyl)cyclohexyl] ester IUPAC Name: 1-O-ethyl 3-O-[1-(2-phenylethynyl)cyclohexyl] propanedioate Traditional Name: malonic acid O1-ethyl ester O3-[1-(2-phenylethynyl)cyclohexyl] ester Formula: C19H22O4 MolecularWeight: 314.37558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)OC1(CCCCC1)C#CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(=O)OC1(CCCCC1)C#CC2=CC=CC=C2

InChI

InChI=1S/C19H22O4/c1-2-22-17(20)15-18(21)23-19(12-7-4-8-13-19)14-11-16-9-5-3-6-10-16/h3,5-6,9-10H,2,4,7-8,12-13,15H2,1H3