methyl (6S)-5-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-5-ium-6-carboxylate

Systemtic Name: methyl (6S)-5-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-5-ium-6-carboxylate Openeye Name: methyl (6S)-5-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-5-ium-6-carboxylate CAS Name: (6S)-5-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-5-ium-6-carboxylic acid methyl ester IUPAC Name: methyl (6S)-5-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-5-ium-6-carboxylate Traditional Name: (6S)-5-methyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-5-ium-6-carboxylic acid methyl ester Formula: C9H14N3O2+ MolecularWeight: 196.22636

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC2=C(CC1C(=O)OC)N=CN2

Isomeric SMILES

C[NH+]1CC2=C(C[C@H]1C(=O)OC)N=CN2

InChI

InChI=1S/C9H13N3O2/c1-12-4-7-6(10-5-11-7)3-8(12)9(13)14-2/h5,8H,3-4H2,1-2H3,(H,10,11)/p+1/t8-/m0/s1