dimethyl 2-hepta-2,6-diynyl-2-hex-5-ynyl-propanedioate

Systemtic Name: dimethyl 2-hepta-2,6-diynyl-2-hex-5-ynyl-propanedioate Openeye Name: dimethyl 2-hepta-2,6-diynyl-2-hex-5-ynyl-propanedioate CAS Name: 2-hepta-2,6-diynyl-2-hex-5-ynylpropanedioic acid dimethyl ester IUPAC Name: dimethyl 2-hepta-2,6-diynyl-2-hex-5-ynylpropanedioate Traditional Name: 2-hepta-2,6-diynyl-2-hex-5-ynyl-malonic acid dimethyl ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCC#C)(CC#CCCC#C)C(=O)OC

Isomeric SMILES

COC(=O)C(CCCCC#C)(CC#CCCC#C)C(=O)OC

InChI

InChI=1S/C18H22O4/c1-5-7-9-11-13-15-18(16(19)21-3,17(20)22-4)14-12-10-8-6-2/h1-2H,7-10,12,14-15H2,3-4H3