1-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperidine-4-carboxamide

Systemtic Name: 1-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperidine-4-carboxamide Openeye Name: 1-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperidine-4-carboxamide CAS Name: 1-[2-(1-pyrrolidin-1-iumylmethyl)-4-quinazolinyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]isonipecotamide Formula: C19H26N5O+ MolecularWeight: 340.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NC3=CC=CC=C3C(=N2)N4CCC(CC4)C(=O)N

Isomeric SMILES

C1CC[NH+](C1)CC2=NC3=CC=CC=C3C(=N2)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C19H25N5O/c20-18(25)14-7-11-24(12-8-14)19-15-5-1-2-6-16(15)21-17(22-19)13-23-9-3-4-10-23/h1-2,5-6,14H,3-4,7-13H2,(H2,20,25)/p+1