1-(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-(6-chloranyl-2-oxidanylidene-4-phenyl-1H-quinolin-3-yl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(6-chloro-2-oxo-4-phenyl-1H-quinolin-3-yl)-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-(6-chloro-2-keto-4-phenyl-1H-quinolin-3-yl)-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C26H30ClN4O2+ MolecularWeight: 465.995

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CCN(CC2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5)C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CCN(CC2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C26H29ClN4O2/c27-19-9-10-21-20(17-19)22(18-7-3-1-4-8-18)23(24(32)29-21)30-15-11-26(12-16-30,25(28)33)31-13-5-2-6-14-31/h1,3-4,7-10,17H,2,5-6,11-16H2,(H2,28,33)(H,29,32)/p+1