ethyl 4-[2-(3-ethenylbenzimidazol-1-ium-1-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(3-ethenylbenzimidazol-1-ium-1-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(3-vinylbenzimidazol-1-ium-1-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(3-ethenyl-1-benzimidazol-1-iumyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3-ethenylbenzimidazol-1-ium-1-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(3-vinylbenzimidazol-1-ium-1-yl)acetyl]amino]benzoic acid ethyl ester Formula: C20H20N3O3+ MolecularWeight: 350.3911

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C[N+]2=CN(C3=CC=CC=C32)C=C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C[N+]2=CN(C3=CC=CC=C32)C=C

InChI

InChI=1S/C20H19N3O3/c1-3-22-14-23(18-8-6-5-7-17(18)22)13-19(24)21-16-11-9-15(10-12-16)20(25)26-4-2/h3,5-12,14H,1,4,13H2,2H3/p+1