methyl 8-imidazol-1-yl-2,2-dimethyl-oct-6-ynoate

Systemtic Name: methyl 8-imidazol-1-yl-2,2-dimethyl-oct-6-ynoate Openeye Name: methyl 8-imidazol-1-yl-2,2-dimethyl-oct-6-ynoate CAS Name: 8-(1-imidazolyl)-2,2-dimethyl-6-octynoic acid methyl ester IUPAC Name: methyl 8-imidazol-1-yl-2,2-dimethyloct-6-ynoate Traditional Name: 8-imidazol-1-yl-2,2-dimethyl-oct-6-ynoic acid methyl ester Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCC#CCN1C=CN=C1)C(=O)OC

Isomeric SMILES

CC(C)(CCCC#CCN1C=CN=C1)C(=O)OC

InChI

InChI=1S/C14H20N2O2/c1-14(2,13(17)18-3)8-6-4-5-7-10-16-11-9-15-12-16/h9,11-12H,4,6,8,10H2,1-3H3