N-[1-(2-fluorophenyl)pyrazol-4-yl]-5'-oxidanidyl-1'-oxidanylidene-spiro[cyclohexane-4,3'-furo[3,4-c]pyridin-5-ium]-1-carboxamide

Systemtic Name: N-[1-(2-fluorophenyl)pyrazol-4-yl]-5'-oxidanidyl-1'-oxidanylidene-spiro[cyclohexane-4,3'-furo[3,4-c]pyridin-5-ium]-1-carboxamide Openeye Name: N-[1-(2-fluorophenyl)pyrazol-4-yl]-5'-oxido-1'-oxo-spiro[cyclohexane-4,3'-furo[3,4-c]pyridin-5-ium]-1-carboxamide CAS Name: N-[1-(2-fluorophenyl)-4-pyrazolyl]-5'-oxido-1'-oxo-1-spiro[cyclohexane-4,3'-furo[3,4-c]pyridin-5-ium]carboxamide IUPAC Name: N-[1-(2-fluorophenyl)pyrazol-4-yl]-5'-oxido-1'-oxospiro[cyclohexane-4,3'-furo[3,4-c]pyridin-5-ium]-1-carboxamide Traditional Name: N-[1-(2-fluorophenyl)pyrazol-4-yl]-1'-keto-5'-oxido-spiro[cyclohexane-4,3'-furo[3,4-c]pyridin-5-ium]-1-carboxamide Formula: C22H19FN4O4 MolecularWeight: 422.409063

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1C(=O)NC3=CN(N=C3)C4=CC=CC=C4F)C5=C(C=C[N+](=C5)[O-])C(=O)O2

Isomeric SMILES

C1CC2(CCC1C(=O)NC3=CN(N=C3)C4=CC=CC=C4F)C5=C(C=C[N+](=C5)[O-])C(=O)O2

InChI

InChI=1S/C22H19FN4O4/c23-18-3-1-2-4-19(18)27-12-15(11-24-27)25-20(28)14-5-8-22(9-6-14)17-13-26(30)10-7-16(17)21(29)31-22/h1-4,7,10-14H,5-6,8-9H2,(H,25,28)