7-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-7-oxidanylidene-heptanoic acid Openeye Name: 7-[(4,5-dimethoxy-2-nitro-phenyl)methoxy]-7-oxo-heptanoic acid CAS Name: 7-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-7-oxoheptanoic acid IUPAC Name: 7-[(4,5-dimethoxy-2-nitrophenyl)methoxy]-7-oxoheptanoic acid Traditional Name: 7-(4,5-dimethoxy-2-nitro-benzyl)oxy-7-keto-enanthic acid Formula: C16H21NO8 MolecularWeight: 355.33984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO8/c1-23-13-8-11(12(17(21)22)9-14(13)24-2)10-25-16(20)7-5-3-4-6-15(18)19/h8-9H,3-7,10H2,1-2H3,(H,18,19)