3-[5-ethoxy-4-(2-methoxy-2-oxidanylidene-ethoxy)-2-nitro-phenyl]propanoic acid

Systemtic Name: 3-[5-ethoxy-4-(2-methoxy-2-oxidanylidene-ethoxy)-2-nitro-phenyl]propanoic acid Openeye Name: 3-[5-ethoxy-4-(2-methoxy-2-oxo-ethoxy)-2-nitro-phenyl]propanoic acid CAS Name: 3-[5-ethoxy-4-(2-methoxy-2-oxoethoxy)-2-nitrophenyl]propanoic acid IUPAC Name: 3-[5-ethoxy-4-(2-methoxy-2-oxoethoxy)-2-nitrophenyl]propanoic acid Traditional Name: 3-[5-ethoxy-4-(2-keto-2-methoxy-ethoxy)-2-nitro-phenyl]propionic acid Formula: C14H17NO8 MolecularWeight: 327.28668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CCC(=O)O)[N+](=O)[O-])OCC(=O)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CCC(=O)O)[N+](=O)[O-])OCC(=O)OC

InChI

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