4-methoxy-3-[[3-(4-nitrophenyl)-3-oxidanylidene-propanoyl]amino]benzoate

Systemtic Name: 4-methoxy-3-[[3-(4-nitrophenyl)-3-oxidanylidene-propanoyl]amino]benzoate Openeye Name: 4-methoxy-3-[[3-(4-nitrophenyl)-3-oxo-propanoyl]amino]benzoate CAS Name: 4-methoxy-3-[[3-(4-nitrophenyl)-1,3-dioxopropyl]amino]benzoate IUPAC Name: 4-methoxy-3-[[3-(4-nitrophenyl)-3-oxopropanoyl]amino]benzoate Traditional Name: 3-[[3-keto-3-(4-nitrophenyl)propanoyl]amino]-4-methoxy-benzoate Formula: C17H13N2O7- MolecularWeight: 357.29432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O7/c1-26-15-7-4-11(17(22)23)8-13(15)18-16(21)9-14(20)10-2-5-12(6-3-10)19(24)25/h2-8H,9H2,1H3,(H,18,21)(H,22,23)/p-1