5-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-5-oxo-pentanoic acid CAS Name: 5-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-5-oxopentanoic acid IUPAC Name: 5-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-5-oxopentanoic acid Traditional Name: 5-(4,5-dimethoxy-2-nitro-benzyl)oxy-5-keto-valeric acid Formula: C14H17NO8 MolecularWeight: 327.28668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)CCCC(=O)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)CCCC(=O)O)[N+](=O)[O-])OC

InChI

InChI=1S/C14H17NO8/c1-21-11-6-9(10(15(19)20)7-12(11)22-2)8-23-14(18)5-3-4-13(16)17/h6-7H,3-5,8H2,1-2H3,(H,16,17)