methyl 2-(1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-5-ium-10-yl)ethanoate

Systemtic Name: methyl 2-(1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-5-ium-10-yl)ethanoate Openeye Name: methyl 2-(1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-5-ium-10-yl)acetate CAS Name: 2-(1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-5-ium-10-yl)acetic acid methyl ester IUPAC Name: methyl 2-(1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-5-ium-10-yl)acetate Traditional Name: 2-(1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-5-ium-10-yl)acetic acid methyl ester Formula: C13H16N3O2+ MolecularWeight: 246.28504

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2[N+]3=C1NCCC3

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2[N+]3=C1NCCC3

InChI

InChI=1S/C13H15N3O2/c1-18-12(17)9-16-11-6-3-2-5-10(11)15-8-4-7-14-13(15)16/h2-3,5-6H,4,7-9H2,1H3/p+1