1-methyl-N-[(3-methylphenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide

Systemtic Name: 1-methyl-N-[(3-methylphenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide Openeye Name: 1-methyl-N-(m-tolylmethyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide CAS Name: 1-methyl-N-[(3-methylphenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide IUPAC Name: 1-methyl-N-[(3-methylphenyl)methyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide Traditional Name: 1-methyl-N-(3-methylbenzyl)-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-ium-3-carboxamide Formula: C16H21N4O+ MolecularWeight: 285.36414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=NN(C3=C2C[NH2+]CC3)C

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=NN(C3=C2C[NH2+]CC3)C

InChI

InChI=1S/C16H20N4O/c1-11-4-3-5-12(8-11)9-18-16(21)15-13-10-17-7-6-14(13)20(2)19-15/h3-5,8,17H,6-7,9-10H2,1-2H3,(H,18,21)/p+1