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

Systemtic Name: 2-bromanyl-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate Openeye Name: 2-bromo-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate CAS Name: 2-bromo-4-nitro-6-[[4-(1-oxopropylamino)phenyl]iminomethyl]phenolate IUPAC Name: 2-bromo-4-nitro-6-[[4-(propanoylamino)phenyl]iminomethyl]phenolate Traditional Name: 2-bromo-4-nitro-6-[(4-propionamidophenyl)iminomethyl]phenolate Formula: C16H13BrN3O4- MolecularWeight: 391.19612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrN3O4/c1-2-15(21)19-12-5-3-11(4-6-12)18-9-10-7-13(20(23)24)8-14(17)16(10)22/h3-9,22H,2H2,1H3,(H,19,21)/p-1