N-(4-methylphenyl)-4-pyrrolidin-1-yl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-(4-methylphenyl)-4-pyrrolidin-1-yl-pyridin-1-ium-2-carboxamide Openeye Name: N-(p-tolyl)-4-pyrrolidin-1-yl-pyridin-1-ium-2-carboxamide CAS Name: N-(4-methylphenyl)-4-(1-pyrrolidinyl)-2-pyridin-1-iumcarboxamide IUPAC Name: N-(4-methylphenyl)-4-pyrrolidin-1-ylpyridin-1-ium-2-carboxamide Traditional Name: N-(p-tolyl)-4-pyrrolidino-pyridin-1-ium-2-carboxamide Formula: C17H20N3O+ MolecularWeight: 282.3602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=[NH+]C=CC(=C2)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=[NH+]C=CC(=C2)N3CCCC3

InChI

InChI=1S/C17H19N3O/c1-13-4-6-14(7-5-13)19-17(21)16-12-15(8-9-18-16)20-10-2-3-11-20/h4-9,12H,2-3,10-11H2,1H3,(H,19,21)/p+1