N-[6-chloranyl-3-(4-fluorophenyl)-4-oxidanylidene-chromen-2-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[6-chloranyl-3-(4-fluorophenyl)-4-oxidanylidene-chromen-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[6-chloro-3-(4-fluorophenyl)-4-oxo-chromen-2-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[6-chloro-3-(4-fluorophenyl)-4-oxo-1-benzopyran-2-yl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[6-chloro-3-(4-fluorophenyl)-4-oxochromen-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[6-chloro-3-(4-fluorophenyl)-4-keto-chromen-2-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C22H21ClFN2O3+ MolecularWeight: 415.865143

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NC2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NC2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H20ClFN2O3/c23-15-6-9-18-17(12-15)21(28)20(14-4-7-16(24)8-5-14)22(29-18)25-19(27)13-26-10-2-1-3-11-26/h4-9,12H,1-3,10-11,13H2,(H,25,27)/p+1