ethyl 1,3-diethyl-2-[(E)-2-[methyl(phenyl)amino]ethenyl]benzimidazol-1-ium-5-carboxylate

Systemtic Name: ethyl 1,3-diethyl-2-[(E)-2-[methyl(phenyl)amino]ethenyl]benzimidazol-1-ium-5-carboxylate Openeye Name: ethyl 1,3-diethyl-2-[(E)-2-(N-methylanilino)vinyl]benzimidazol-1-ium-5-carboxylate CAS Name: 1,3-diethyl-2-[(E)-2-(N-methylanilino)ethenyl]-5-benzimidazol-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1,3-diethyl-2-[(E)-2-(N-methylanilino)ethenyl]benzimidazol-1-ium-5-carboxylate Traditional Name: 1,3-diethyl-2-[(E)-2-(N-methylanilino)vinyl]benzimidazol-1-ium-5-carboxylic acid ethyl ester Formula: C23H28N3O2+ MolecularWeight: 378.48732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)C(=O)OCC)[N+](=C1C=CN(C)C3=CC=CC=C3)CC

Isomeric SMILES

CCN1C2=C(C=CC(=C2)C(=O)OCC)[N+](=C1/C=C/N(C)C3=CC=CC=C3)CC

InChI

InChI=1S/C23H28N3O2/c1-5-25-20-14-13-18(23(27)28-7-3)17-21(20)26(6-2)22(25)15-16-24(4)19-11-9-8-10-12-19/h8-17H,5-7H2,1-4H3/q+1