(4-fluorophenyl)methyl-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl]azanium

Systemtic Name: (4-fluorophenyl)methyl-[(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl]azanium Openeye Name: (4-fluorophenyl)methyl-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: (4-fluorophenyl)methyl-[(7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: (4-fluorophenyl)methyl-[(7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl]azanium Traditional Name: (4-fluorobenzyl)-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl]ammonium Formula: C21H23FNO2+ MolecularWeight: 340.411223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]CC3=CC=C(C=C3)F)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)C[NH2+]CC3=CC=C(C=C3)F)C(C)C

InChI

InChI=1S/C21H22FNO2/c1-13(2)18-10-19-16(9-21(24)25-20(19)8-14(18)3)12-23-11-15-4-6-17(22)7-5-15/h4-10,13,23H,11-12H2,1-3H3/p+1