1-ethyl-2-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-5-carbonitrile

Systemtic Name: 1-ethyl-2-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-5-carbonitrile Openeye Name: 1-ethyl-2-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-5-carbonitrile CAS Name: 1-ethyl-2-methyl-3-(2-phenoxyethyl)-5-benzimidazol-1-iumcarbonitrile IUPAC Name: 1-ethyl-2-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-5-carbonitrile Traditional Name: 1-ethyl-2-methyl-3-(2-phenoxyethyl)benzimidazol-1-ium-5-carbonitrile Formula: C19H20N3O+ MolecularWeight: 306.3816

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N(C2=C1C=CC(=C2)C#N)CCOC3=CC=CC=C3)C

Isomeric SMILES

CC[N+]1=C(N(C2=C1C=CC(=C2)C#N)CCOC3=CC=CC=C3)C

InChI

InChI=1S/C19H20N3O/c1-3-21-15(2)22(11-12-23-17-7-5-4-6-8-17)19-13-16(14-20)9-10-18(19)21/h4-10,13H,3,11-12H2,1-2H3/q+1