5-[(3-methylimidazol-4-yl)methyl]-3-propyl-oxolan-2-one

Systemtic Name: 5-[(3-methylimidazol-4-yl)methyl]-3-propyl-oxolan-2-one Openeye Name: 5-[(3-methylimidazol-4-yl)methyl]-3-propyl-tetrahydrofuran-2-one CAS Name: 5-[(3-methyl-4-imidazolyl)methyl]-3-propyl-2-oxolanone IUPAC Name: 5-[(3-methylimidazol-4-yl)methyl]-3-propyloxolan-2-one Traditional Name: 5-[(3-methylimidazol-4-yl)methyl]-3-propyl-tetrahydrofuran-2-one Formula: C12H18N2O2 MolecularWeight: 222.28352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(OC1=O)CC2=CN=CN2C

Isomeric SMILES

CCCC1CC(OC1=O)CC2=CN=CN2C

InChI

InChI=1S/C12H18N2O2/c1-3-4-9-5-11(16-12(9)15)6-10-7-13-8-14(10)2/h7-9,11H,3-6H2,1-2H3