cyclopropyl-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-[(2-fluorophenyl)methyl]azanium

Systemtic Name: cyclopropyl-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-[(2-fluorophenyl)methyl]azanium Openeye Name: cyclopropyl-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl]-[(2-fluorophenyl)methyl]ammonium CAS Name: cyclopropyl-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]-[(2-fluorophenyl)methyl]ammonium IUPAC Name: cyclopropyl-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl]-[(2-fluorophenyl)methyl]azanium Traditional Name: cyclopropyl-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl]-(2-fluorobenzyl)ammonium Formula: C22H23FNO3+ MolecularWeight: 368.421323

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](CC3=CC=CC=C3F)C4CC4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](CC3=CC=CC=C3F)C4CC4)O

InChI

InChI=1S/C22H22FNO3/c1-2-14-9-18-16(10-22(26)27-21(18)11-20(14)25)13-24(17-7-8-17)12-15-5-3-4-6-19(15)23/h3-6,9-11,17,25H,2,7-8,12-13H2,1H3/p+1