4-chloranyl-2-(3-methoxypropyliminomethyl)-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-(3-methoxypropyliminomethyl)-6-nitro-phenolate Openeye Name: 4-chloro-2-(3-methoxypropyliminomethyl)-6-nitro-phenolate CAS Name: 4-chloro-2-(3-methoxypropyliminomethyl)-6-nitrophenolate IUPAC Name: 4-chloro-2-(3-methoxypropyliminomethyl)-6-nitrophenolate Traditional Name: 4-chloro-2-(3-methoxypropyliminomethyl)-6-nitro-phenolate Formula: C11H12ClN2O4- MolecularWeight: 271.67698

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN=CC1=CC(=CC(=C1[O-])[N+](=O)[O-])Cl

Isomeric SMILES

COCCCN=CC1=CC(=CC(=C1[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C11H13ClN2O4/c1-18-4-2-3-13-7-8-5-9(12)6-10(11(8)15)14(16)17/h5-7,15H,2-4H2,1H3/p-1