4-[[2-imidazol-1-yl-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2-imidazol-1-yl-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[2-imidazol-1-yl-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]benzonitrile CAS Name: 4-[[2-(1-imidazolyl)-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]benzonitrile IUPAC Name: 4-[[2-imidazol-1-yl-4-(prop-2-ynoxymethyl)-1,3-dioxolan-2-yl]methyl]benzonitrile Traditional Name: 4-[[2-imidazol-1-yl-4-(propargyloxymethyl)-1,3-dioxolan-2-yl]methyl]benzonitrile Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOCC1COC(O1)(CC2=CC=C(C=C2)C#N)N3C=CN=C3

Isomeric SMILES

C#CCOCC1COC(O1)(CC2=CC=C(C=C2)C#N)N3C=CN=C3

InChI

InChI=1S/C18H17N3O3/c1-2-9-22-12-17-13-23-18(24-17,21-8-7-20-14-21)10-15-3-5-16(11-19)6-4-15/h1,3-8,14,17H,9-10,12-13H2