2-ethoxy-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate

Systemtic Name: 2-ethoxy-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate Openeye Name: 2-ethoxy-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate CAS Name: 2-ethoxy-4-nitro-6-[[4-(1-oxopropylamino)phenyl]iminomethyl]phenolate IUPAC Name: 2-ethoxy-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate Traditional Name: 2-ethoxy-4-nitro-6-[(4-propionamidophenyl)iminomethyl]phenolate Formula: C18H18N3O5- MolecularWeight: 356.35262

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)N=CC2=CC(=CC(=C2[O-])OCC)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)N=CC2=CC(=CC(=C2[O-])OCC)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5/c1-3-17(22)20-14-7-5-13(6-8-14)19-11-12-9-15(21(24)25)10-16(18(12)23)26-4-2/h5-11,23H,3-4H2,1-2H3,(H,20,22)/p-1