ethyl 3-(3-methylimidazol-4-yl)prop-2-ynoate

Systemtic Name: ethyl 3-(3-methylimidazol-4-yl)prop-2-ynoate Openeye Name: ethyl 3-(3-methylimidazol-4-yl)prop-2-ynoate CAS Name: 3-(3-methyl-4-imidazolyl)-2-propynoic acid ethyl ester IUPAC Name: ethyl 3-(3-methylimidazol-4-yl)prop-2-ynoate Traditional Name: 3-(3-methylimidazol-4-yl)propiolic acid ethyl ester Formula: C9H10N2O2 MolecularWeight: 178.1879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C#CC1=CN=CN1C

Isomeric SMILES

CCOC(=O)C#CC1=CN=CN1C

InChI

InChI=1S/C9H10N2O2/c1-3-13-9(12)5-4-8-6-10-7-11(8)2/h6-7H,3H2,1-2H3