6-(azepan-1-yl)-N-ethyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 6-(azepan-1-yl)-N-ethyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]pyridine-3-carboxamide Openeye Name: 6-(azepan-1-yl)-N-ethyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]pyridine-3-carboxamide CAS Name: 6-(1-azepanyl)-N-ethyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]-3-pyridinecarboxamide IUPAC Name: 6-(azepan-1-yl)-N-ethyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]pyridine-3-carboxamide Traditional Name: 6-(azepan-1-yl)-N-ethyl-N-[(3-methyl-1H-imidazol-3-ium-2-yl)methyl]nicotinamide Formula: C19H28N5O+ MolecularWeight: 342.45852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=[N+](C=CN1)C)C(=O)C2=CN=C(C=C2)N3CCCCCC3

Isomeric SMILES

CCN(CC1=[N+](C=CN1)C)C(=O)C2=CN=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C19H27N5O/c1-3-23(15-18-20-10-13-22(18)2)19(25)16-8-9-17(21-14-16)24-11-6-4-5-7-12-24/h8-10,13-14H,3-7,11-12,15H2,1-2H3/p+1