4-chloranyl-2-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-nitro-phenolate Openeye Name: 4-chloro-2-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-nitro-phenolate CAS Name: 4-chloro-2-[2-(4-morpholin-4-iumyl)ethyliminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-nitrophenolate Traditional Name: 4-chloro-2-(2-morpholin-4-ium-4-ylethyliminomethyl)-6-nitro-phenolate Formula: C13H16ClN3O4 MolecularWeight: 313.73684

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1COCC[NH+]1CCN=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C13H16ClN3O4/c14-11-7-10(13(18)12(8-11)17(19)20)9-15-1-2-16-3-5-21-6-4-16/h7-9,18H,1-6H2