O1-ethyl O3-methyl 2-(5-phenylpent-4-ynyl)propanedioate

Systemtic Name: O1-ethyl O3-methyl 2-(5-phenylpent-4-ynyl)propanedioate Openeye Name: O1-ethyl O3-methyl 2-(5-phenylpent-4-ynyl)propanedioate CAS Name: 2-(5-phenylpent-4-ynyl)propanedioic acid O1-ethyl ester O3-methyl ester IUPAC Name: 1-O-ethyl 3-O-methyl 2-(5-phenylpent-4-ynyl)propanedioate Traditional Name: 2-(5-phenylpent-4-ynyl)malonic acid O1-ethyl ester O3-methyl ester Formula: C17H20O4 MolecularWeight: 288.3383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC#CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCOC(=O)C(CCCC#CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C17H20O4/c1-3-21-17(19)15(16(18)20-2)13-9-5-8-12-14-10-6-4-7-11-14/h4,6-7,10-11,15H,3,5,9,13H2,1-2H3