[3-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-inden-5-yl] 2,2-dimethylpropanoate

Systemtic Name: [3-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-inden-5-yl] 2,2-dimethylpropanoate Openeye Name: [3-(1H-imidazol-5-ylmethyl)indan-5-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-inden-5-yl] ester IUPAC Name: [3-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1H-inden-5-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [3-(1H-imidazol-5-ylmethyl)indan-5-yl] ester Formula: C18H22N2O2 MolecularWeight: 298.37948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC2=C(CCC2CC3=CN=CN3)C=C1

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC2=C(CCC2CC3=CN=CN3)C=C1

InChI

InChI=1S/C18H22N2O2/c1-18(2,3)17(21)22-15-7-6-12-4-5-13(16(12)9-15)8-14-10-19-11-20-14/h6-7,9-11,13H,4-5,8H2,1-3H3,(H,19,20)