2-[[2-(3-fluoranyl-4-methoxy-phenyl)ethanoylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[2-(3-fluoranyl-4-methoxy-phenyl)ethanoylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[2-(3-fluoro-4-methoxy-phenyl)acetyl]amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[2-(3-fluoro-4-methoxyphenyl)-1-oxoethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[[2-(3-fluoro-4-methoxyphenyl)acetyl]amino]methyl]-4-nitrophenolate Traditional Name: 2-[[[2-(3-fluoro-4-methoxy-phenyl)acetyl]amino]methyl]-4-nitro-phenolate Formula: C16H14FN2O5- MolecularWeight: 333.291163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])F

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-])F

InChI

InChI=1S/C16H15FN2O5/c1-24-15-5-2-10(6-13(15)17)7-16(21)18-9-11-8-12(19(22)23)3-4-14(11)20/h2-6,8,20H,7,9H2,1H3,(H,18,21)/p-1