ethyl 3-methyl-5-phenyl-1,2-dihydropyrido[1,2-a]benzimidazol-10-ium-4-carboxylate

Systemtic Name: ethyl 3-methyl-5-phenyl-1,2-dihydropyrido[1,2-a]benzimidazol-10-ium-4-carboxylate Openeye Name: ethyl 3-methyl-5-phenyl-1,2-dihydropyrido[1,2-a]benzimidazol-10-ium-4-carboxylate CAS Name: 3-methyl-5-phenyl-1,2-dihydropyrido[1,2-a]benzimidazol-10-ium-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-phenyl-1,2-dihydropyrido[1,2-a]benzimidazol-10-ium-4-carboxylate Traditional Name: 3-methyl-5-phenyl-1,2-dihydropyrido[1,2-a]benzimidazol-10-ium-4-carboxylic acid ethyl ester Formula: C21H21N2O2+ MolecularWeight: 333.40364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(CC[N+]2=C1N(C3=CC=CC=C32)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(CC[N+]2=C1N(C3=CC=CC=C32)C4=CC=CC=C4)C

InChI

InChI=1S/C21H21N2O2/c1-3-25-21(24)19-15(2)13-14-22-17-11-7-8-12-18(17)23(20(19)22)16-9-5-4-6-10-16/h4-12H,3,13-14H2,1-2H3/q+1