2-ethoxy-6-(3-morpholin-4-ium-4-ylpropyliminomethyl)-4-nitro-phenolate

Systemtic Name: 2-ethoxy-6-(3-morpholin-4-ium-4-ylpropyliminomethyl)-4-nitro-phenolate Openeye Name: 2-ethoxy-6-(3-morpholin-4-ium-4-ylpropyliminomethyl)-4-nitro-phenolate CAS Name: 2-ethoxy-6-[3-(4-morpholin-4-iumyl)propyliminomethyl]-4-nitrophenolate IUPAC Name: 2-ethoxy-6-(3-morpholin-4-ium-4-ylpropyliminomethyl)-4-nitrophenolate Traditional Name: 2-ethoxy-6-(3-morpholin-4-ium-4-ylpropyliminomethyl)-4-nitro-phenolate Formula: C16H23N3O5 MolecularWeight: 337.37092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NCCC[NH+]2CCOCC2)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=NCCC[NH+]2CCOCC2)[O-]

InChI

InChI=1S/C16H23N3O5/c1-2-24-15-11-14(19(21)22)10-13(16(15)20)12-17-4-3-5-18-6-8-23-9-7-18/h10-12,20H,2-9H2,1H3