2-[[2-(5-ethanoyl-2-methoxy-phenyl)ethanoylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[2-(5-ethanoyl-2-methoxy-phenyl)ethanoylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[2-(5-acetyl-2-methoxy-phenyl)acetyl]amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[2-(5-acetyl-2-methoxyphenyl)-1-oxoethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[[2-(5-acetyl-2-methoxyphenyl)acetyl]amino]methyl]-4-nitrophenolate Traditional Name: 2-[[[2-(5-acetyl-2-methoxy-phenyl)acetyl]amino]methyl]-4-nitro-phenolate Formula: C18H17N2O6- MolecularWeight: 357.33738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6/c1-11(21)12-3-6-17(26-2)13(7-12)9-18(23)19-10-14-8-15(20(24)25)4-5-16(14)22/h3-8,22H,9-10H2,1-2H3,(H,19,23)/p-1