1-[(3-chloranyl-11-oxidanylidene-5H-pyrido[2,1-b]quinazolin-10-ium-8-yl)carbonyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-chloranyl-11-oxidanylidene-5H-pyrido[2,1-b]quinazolin-10-ium-8-yl)carbonyl]piperidine-4-carboxamide Openeye Name: 1-(3-chloro-11-oxo-5H-pyrido[2,1-b]quinazolin-10-ium-8-carbonyl)piperidine-4-carboxamide CAS Name: 1-[(3-chloro-11-oxo-5H-pyrido[2,1-b]quinazolin-10-ium-8-yl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-11-oxo-5H-pyrido[2,1-b]quinazolin-10-ium-8-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(3-chloro-11-keto-5H-pyrido[2,1-b]quinazolin-10-ium-8-carbonyl)isonipecotamide Formula: C19H18ClN4O3+ MolecularWeight: 385.82422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C(=O)C2=C[N+]3=C(C=C2)NC4=C(C3=O)C=CC(=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N)C(=O)C2=C[N+]3=C(C=C2)NC4=C(C3=O)C=CC(=C4)Cl

InChI

InChI=1S/C19H17ClN4O3/c20-13-2-3-14-15(9-13)22-16-4-1-12(10-24(16)19(14)27)18(26)23-7-5-11(6-8-23)17(21)25/h1-4,9-11H,5-8H2,(H2,21,25)/p+1