methyl 8-imidazol-1-yloct-2-ynoate

Systemtic Name: methyl 8-imidazol-1-yloct-2-ynoate Openeye Name: methyl 8-imidazol-1-yloct-2-ynoate CAS Name: 8-(1-imidazolyl)-2-octynoic acid methyl ester IUPAC Name: methyl 8-imidazol-1-yloct-2-ynoate Traditional Name: 8-imidazol-1-yloct-2-ynoic acid methyl ester Formula: C12H16N2O2 MolecularWeight: 220.26764

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C#CCCCCCN1C=CN=C1

Isomeric SMILES

COC(=O)C#CCCCCCN1C=CN=C1

InChI

InChI=1S/C12H16N2O2/c1-16-12(15)7-5-3-2-4-6-9-14-10-8-13-11-14/h8,10-11H,2-4,6,9H2,1H3