(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-methyl-azanium

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-methyl-azanium Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl-[(3-fluoro-4-methoxy-phenyl)methyl]-methyl-ammonium CAS Name: (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[(3-fluoro-4-methoxyphenyl)methyl]-methylammonium IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl-[(3-fluoro-4-methoxyphenyl)methyl]-methylazanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]-methyl-ammonium Formula: C21H23FNO3+ MolecularWeight: 356.410623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC(=C(C=C3)OC)F)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH+](C)CC3=CC(=C(C=C3)OC)F)C

InChI

InChI=1S/C21H22FNO3/c1-13-7-17-16(10-21(24)26-20(17)8-14(13)2)12-23(3)11-15-5-6-19(25-4)18(22)9-15/h5-10H,11-12H2,1-4H3/p+1