methyl (6S)-5-methyl-3-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ium-6-carboxylate

Systemtic Name: methyl (6S)-5-methyl-3-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ium-6-carboxylate Openeye Name: methyl (6S)-5-methyl-3-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ium-6-carboxylate CAS Name: (6S)-5-methyl-3-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ium-6-carboxylic acid methyl ester IUPAC Name: methyl (6S)-5-methyl-3-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ium-6-carboxylate Traditional Name: (6S)-5-methyl-3-propyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-5-ium-6-carboxylic acid methyl ester Formula: C12H20N3O2+ MolecularWeight: 238.3061

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C[NH+](C(C2)C(=O)OC)C

Isomeric SMILES

CCCN1C=NC2=C1C[NH+]([C@@H](C2)C(=O)OC)C

InChI

InChI=1S/C12H19N3O2/c1-4-5-15-8-13-9-6-10(12(16)17-3)14(2)7-11(9)15/h8,10H,4-7H2,1-3H3/p+1/t10-/m0/s1