N-[4-(6-chloranyl-4-phenyl-quinolin-2-yl)phenyl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[4-(6-chloranyl-4-phenyl-quinolin-2-yl)phenyl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[4-(6-chloro-4-phenyl-2-quinolyl)phenyl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[4-(6-chloro-4-phenyl-2-quinolinyl)phenyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[4-(6-chloro-4-phenylquinolin-2-yl)phenyl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[4-(6-chloro-4-phenyl-2-quinolyl)phenyl]-2-piperidin-1-ium-1-yl-acetamide Formula: C28H27ClN3O+ MolecularWeight: 456.98648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)Cl)C(=C3)C5=CC=CC=C5

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)Cl)C(=C3)C5=CC=CC=C5

InChI

InChI=1S/C28H26ClN3O/c29-22-11-14-26-25(17-22)24(20-7-3-1-4-8-20)18-27(31-26)21-9-12-23(13-10-21)30-28(33)19-32-15-5-2-6-16-32/h1,3-4,7-14,17-18H,2,5-6,15-16,19H2,(H,30,33)/p+1