2-[(4R)-2-azanyl-4-(2-fluorophenyl)-3-methoxycarbonyl-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4R)-2-azanyl-4-(2-fluorophenyl)-3-methoxycarbonyl-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(4R)-2-amino-4-(2-fluorophenyl)-3-methoxycarbonyl-7-methyl-5-oxo-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(4R)-2-amino-4-(2-fluorophenyl)-3-methoxycarbonyl-7-methyl-5-oxo-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethylammonium IUPAC Name: 2-[(4R)-2-amino-4-(2-fluorophenyl)-3-methoxycarbonyl-7-methyl-5-oxo-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethylazanium Traditional Name: 2-[(4R)-2-amino-3-carbomethoxy-4-(2-fluorophenyl)-5-keto-7-methyl-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethyl-ammonium Formula: C21H25FN3O4+ MolecularWeight: 402.439303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(C(=C(O2)N)C(=O)OC)C3=CC=CC=C3F)C(=O)N1CC[NH+](C)C

Isomeric SMILES

CC1=CC2=C([C@H](C(=C(O2)N)C(=O)OC)C3=CC=CC=C3F)C(=O)N1CC[NH+](C)C

InChI

InChI=1S/C21H24FN3O4/c1-12-11-15-17(20(26)25(12)10-9-24(2)3)16(13-7-5-6-8-14(13)22)18(19(23)29-15)21(27)28-4/h5-8,11,16H,9-10,23H2,1-4H3/p+1/t16-/m1/s1