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

Systemtic Name: butyl 4-[2-(3-ethenylbenzimidazol-1-ium-1-yl)ethanoylamino]benzoate Openeye Name: butyl 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 butyl ester IUPAC Name: butyl 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 butyl ester Formula: C22H24N3O3+ MolecularWeight: 378.44426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3/c1-3-5-14-28-22(27)17-10-12-18(13-11-17)23-21(26)15-25-16-24(4-2)19-8-6-7-9-20(19)25/h4,6-13,16H,2-3,5,14-15H2,1H3/p+1