1-(11-oxidanylidenepyrido[2,1-b]quinazolin-6-yl)carbonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-(11-oxidanylidenepyrido[2,1-b]quinazolin-6-yl)carbonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-(11-oxopyrido[2,1-b]quinazoline-6-carbonyl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[oxo-(11-oxo-6-pyrido[2,1-b]quinazolinyl)methyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(11-oxopyrido[2,1-b]quinazoline-6-carbonyl)-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-(11-ketopyrido[2,1-b]quinazoline-6-carbonyl)-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C24H28N5O3+ MolecularWeight: 434.51082

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CCN(CC2)C(=O)C3=CC=CN4C3=NC5=CC=CC=C5C4=O)C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CCN(CC2)C(=O)C3=CC=CN4C3=NC5=CC=CC=C5C4=O)C(=O)N

InChI

InChI=1S/C24H27N5O3/c25-23(32)24(28-12-4-1-5-13-28)10-15-27(16-11-24)21(30)18-8-6-14-29-20(18)26-19-9-3-2-7-17(19)22(29)31/h2-3,6-9,14H,1,4-5,10-13,15-16H2,(H2,25,32)/p+1