1-[[2-(4-methylphenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole

Systemtic Name: 1-[[2-(4-methylphenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole Openeye Name: 1-[[4-(prop-2-ynoxymethyl)-2-(p-tolyl)-1,3-dioxolan-2-yl]methyl]imidazole CAS Name: 1-[[2-(4-methylphenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole IUPAC Name: 1-[[2-(4-methylphenyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]imidazole Traditional Name: 1-[[4-(propargyloxymethyl)-2-(p-tolyl)-1,3-dioxolan-2-yl]methyl]imidazole Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(OCC(O2)COCC#C)CN3C=CN=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2(OCC(O2)COCC#C)CN3C=CN=C3

InChI

InChI=1S/C18H20N2O3/c1-3-10-21-11-17-12-22-18(23-17,13-20-9-8-19-14-20)16-6-4-15(2)5-7-16/h1,4-9,14,17H,10-13H2,2H3