methyl 8-chloranyl-2-(2,2-dimethoxyethanoyl)oct-4-ynoate

Systemtic Name: methyl 8-chloranyl-2-(2,2-dimethoxyethanoyl)oct-4-ynoate Openeye Name: methyl 8-chloro-2-(2,2-dimethoxyacetyl)oct-4-ynoate CAS Name: 8-chloro-2-(2,2-dimethoxy-1-oxoethyl)-4-octynoic acid methyl ester IUPAC Name: methyl 8-chloro-2-(2,2-dimethoxyacetyl)oct-4-ynoate Traditional Name: 8-chloro-2-(2,2-dimethoxyacetyl)oct-4-ynoic acid methyl ester Formula: C13H19ClO5 MolecularWeight: 290.73996

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(=O)C(CC#CCCCCl)C(=O)OC)OC

Isomeric SMILES

COC(C(=O)C(CC#CCCCCl)C(=O)OC)OC

InChI

InChI=1S/C13H19ClO5/c1-17-12(16)10(8-6-4-5-7-9-14)11(15)13(18-2)19-3/h10,13H,5,7-9H2,1-3H3