2-[(4-methoxy-4-oxidanylidene-butyl)iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[(4-methoxy-4-oxidanylidene-butyl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(4-methoxy-4-oxo-butyl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[(4-methoxy-4-oxobutyl)iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(4-methoxy-4-oxobutyl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(4-keto-4-methoxy-butyl)iminomethyl]-4-nitro-phenolate Formula: C12H13N2O5- MolecularWeight: 265.24202

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-]

Isomeric SMILES

COC(=O)CCCN=CC1=C(C=CC(=C1)[N+](=O)[O-])[O-]

InChI

InChI=1S/C12H14N2O5/c1-19-12(16)3-2-6-13-8-9-7-10(14(17)18)4-5-11(9)15/h4-5,7-8,15H,2-3,6H2,1H3/p-1