N-[(Z)-(5,5-dimethyl-3-pyrrolidin-1-ium-1-yl-cyclohex-2-en-1-ylidene)amino]pyridine-3-carboxamide

Systemtic Name: N-[(Z)-(5,5-dimethyl-3-pyrrolidin-1-ium-1-yl-cyclohex-2-en-1-ylidene)amino]pyridine-3-carboxamide Openeye Name: N-[(Z)-(5,5-dimethyl-3-pyrrolidin-1-ium-1-yl-cyclohex-2-en-1-ylidene)amino]pyridine-3-carboxamide CAS Name: N-[(Z)-[5,5-dimethyl-3-(1-pyrrolidin-1-iumyl)-1-cyclohex-2-enylidene]amino]-3-pyridinecarboxamide IUPAC Name: N-[(Z)-(5,5-dimethyl-3-pyrrolidin-1-ium-1-ylcyclohex-2-en-1-ylidene)amino]pyridine-3-carboxamide Traditional Name: N-[(Z)-(5,5-dimethyl-3-pyrrolidin-1-ium-1-yl-cyclohex-2-en-1-ylidene)amino]nicotinamide Formula: C18H25N4O+ MolecularWeight: 313.4173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=NNC(=O)C2=CN=CC=C2)C1)[NH+]3CCCC3)C

Isomeric SMILES

CC1(CC(=C/C(=N\NC(=O)C2=CN=CC=C2)/C1)[NH+]3CCCC3)C

InChI

InChI=1S/C18H24N4O/c1-18(2)11-15(10-16(12-18)22-8-3-4-9-22)20-21-17(23)14-6-5-7-19-13-14/h5-7,10,13H,3-4,8-9,11-12H2,1-2H3,(H,21,23)/p+1/b20-15+