(3-fluoranyl-4-methoxy-phenyl)methyl-[(2R)-1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl-[(2R)-1-[(2-methoxy-5-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl-[(1R)-2-(2-methoxy-5-nitro-anilino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: (3-fluoro-4-methoxyphenyl)methyl-[(2R)-1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl-[(2R)-1-(2-methoxy-5-nitroanilino)-1-oxopropan-2-yl]-methylazanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[(1R)-2-keto-2-(2-methoxy-5-nitro-anilino)-1-methyl-ethyl]-methyl-ammonium Formula: C19H23FN3O5+ MolecularWeight: 392.401423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)[NH+](C)CC2=CC(=C(C=C2)OC)F

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)[NH+](C)CC2=CC(=C(C=C2)OC)F

InChI

InChI=1S/C19H22FN3O5/c1-12(22(2)11-13-5-7-17(27-3)15(20)9-13)19(24)21-16-10-14(23(25)26)6-8-18(16)28-4/h5-10,12H,11H2,1-4H3,(H,21,24)/p+1/t12-/m1/s1