[1-[3-(3-fluorophenyl)-2-methyl-4-oxidanylidene-chromen-7-yl]oxy-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [1-[3-(3-fluorophenyl)-2-methyl-4-oxidanylidene-chromen-7-yl]oxy-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [1-[3-(3-fluorophenyl)-2-methyl-4-oxo-chromen-7-yl]oxycarbonyl-2-methyl-butyl]ammonium CAS Name: [1-[[3-(3-fluorophenyl)-2-methyl-4-oxo-1-benzopyran-7-yl]oxy]-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [1-[3-(3-fluorophenyl)-2-methyl-4-oxochromen-7-yl]oxy-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [1-[3-(3-fluorophenyl)-4-keto-2-methyl-chromen-7-yl]oxycarbonyl-2-methyl-butyl]ammonium Formula: C22H23FNO4+ MolecularWeight: 384.420723

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C)C3=CC(=CC=C3)F)[NH3+]

Isomeric SMILES

CCC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C)C3=CC(=CC=C3)F)[NH3+]

InChI

InChI=1S/C22H22FNO4/c1-4-12(2)20(24)22(26)28-16-8-9-17-18(11-16)27-13(3)19(21(17)25)14-6-5-7-15(23)10-14/h5-12,20H,4,24H2,1-3H3/p+1