1-(cyanomethyl)-N-(diphenylmethyl)imidazol-1-ium-1-carboxamide

Systemtic Name: 1-(cyanomethyl)-N-(diphenylmethyl)imidazol-1-ium-1-carboxamide Openeye Name: N-benzhydryl-1-(cyanomethyl)imidazol-1-ium-1-carboxamide CAS Name: 1-(cyanomethyl)-N-(diphenylmethyl)-1-imidazol-1-iumcarboxamide IUPAC Name: N-benzhydryl-1-(cyanomethyl)imidazol-1-ium-1-carboxamide Traditional Name: N-benzhydryl-1-(cyanomethyl)imidazol-1-ium-1-carboxamide Formula: C19H17N4O+ MolecularWeight: 317.36448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)[N+]3(C=CN=C3)CC#N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)[N+]3(C=CN=C3)CC#N

InChI

InChI=1S/C19H16N4O/c20-11-13-23(14-12-21-15-23)19(24)22-18(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,12,14-15,18H,13H2/p+1