6-azanyl-1-(2,4-dimethoxyphenyl)-5-(4-fluorophenyl)carbonyl-3H-pyridin-1-ium-2-one

Systemtic Name: 6-azanyl-1-(2,4-dimethoxyphenyl)-5-(4-fluorophenyl)carbonyl-3H-pyridin-1-ium-2-one Openeye Name: 6-amino-1-(2,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-3H-pyridin-1-ium-2-one CAS Name: 6-amino-1-(2,4-dimethoxyphenyl)-5-[(4-fluorophenyl)-oxomethyl]-3H-pyridin-1-ium-2-one IUPAC Name: 6-amino-1-(2,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-3H-pyridin-1-ium-2-one Traditional Name: 6-amino-1-(2,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-3H-pyridin-1-ium-2-one Formula: C20H18FN2O4+ MolecularWeight: 369.366323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)[N+]2=C(C(=CCC2=O)C(=O)C3=CC=C(C=C3)F)N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[N+]2=C(C(=CCC2=O)C(=O)C3=CC=C(C=C3)F)N)OC

InChI

InChI=1S/C20H17FN2O4/c1-26-14-7-9-16(17(11-14)27-2)23-18(24)10-8-15(20(23)22)19(25)12-3-5-13(21)6-4-12/h3-9,11,22H,10H2,1-2H3/p+1