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

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[2-(2-fluorophenyl)ethyl]azanium Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl-[2-(2-fluorophenyl)ethyl]ammonium CAS Name: (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[2-(2-fluorophenyl)ethyl]ammonium IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl-[2-(2-fluorophenyl)ethyl]azanium Traditional Name: 2-(2-fluorophenyl)ethyl-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]ammonium Formula: C20H21FNO2+ MolecularWeight: 326.384643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CCC3=CC=CC=C3F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CCC3=CC=CC=C3F)C

InChI

InChI=1S/C20H20FNO2/c1-13-9-17-16(11-20(23)24-19(17)10-14(13)2)12-22-8-7-15-5-3-4-6-18(15)21/h3-6,9-11,22H,7-8,12H2,1-2H3/p+1