4-(3-azanyl-3-oxidanylidene-propoxy)-5-methoxy-2-nitro-benzoic acid

Systemtic Name: 4-(3-azanyl-3-oxidanylidene-propoxy)-5-methoxy-2-nitro-benzoic acid Openeye Name: 4-(3-amino-3-oxo-propoxy)-5-methoxy-2-nitro-benzoic acid CAS Name: 4-(3-amino-3-oxopropoxy)-5-methoxy-2-nitrobenzoic acid IUPAC Name: 4-(3-amino-3-oxopropoxy)-5-methoxy-2-nitrobenzoic acid Traditional Name: 4-(3-amino-3-keto-propoxy)-5-methoxy-2-nitro-benzoic acid Formula: C11H12N2O7 MolecularWeight: 284.22218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)[N+](=O)[O-])OCCC(=O)N

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)[N+](=O)[O-])OCCC(=O)N

InChI

InChI=1S/C11H12N2O7/c1-19-8-4-6(11(15)16)7(13(17)18)5-9(8)20-3-2-10(12)14/h4-5H,2-3H2,1H3,(H2,12,14)(H,15,16)