4-chloranyl-2-[(4-methoxy-4-oxidanylidene-butyl)iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-chloranyl-2-[(4-methoxy-4-oxidanylidene-butyl)iminomethyl]-6-nitro-phenolate Openeye Name: 4-chloro-2-[(4-methoxy-4-oxo-butyl)iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[(4-methoxy-4-oxobutyl)iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[(4-methoxy-4-oxobutyl)iminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[(4-keto-4-methoxy-butyl)iminomethyl]-6-nitro-phenolate Formula: C12H12ClN2O5- MolecularWeight: 299.68708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClN2O5/c1-20-11(16)3-2-4-14-7-8-5-9(13)6-10(12(8)17)15(18)19/h5-7,17H,2-4H2,1H3/p-1