2-bromanyl-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-bromanyl-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-bromo-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-bromo-6-[[4-(4-morpholin-4-iumylmethyl)phenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-bromo-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-bromo-6-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]iminomethyl]-4-nitro-phenolate Formula: C18H18BrN3O4 MolecularWeight: 420.25722

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)N=CC3=CC(=CC(=C3[O-])Br)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)N=CC3=CC(=CC(=C3[O-])Br)[N+](=O)[O-]

InChI

InChI=1S/C18H18BrN3O4/c19-17-10-16(22(24)25)9-14(18(17)23)11-20-15-3-1-13(2-4-15)12-21-5-7-26-8-6-21/h1-4,9-11,23H,5-8,12H2