3,3-bis(4,5-dimethoxy-2-nitro-phenyl)propanoic acid

Systemtic Name: 3,3-bis(4,5-dimethoxy-2-nitro-phenyl)propanoic acid Openeye Name: 3,3-bis(4,5-dimethoxy-2-nitro-phenyl)propanoic acid CAS Name: 3,3-bis(4,5-dimethoxy-2-nitrophenyl)propanoic acid IUPAC Name: 3,3-bis(4,5-dimethoxy-2-nitrophenyl)propanoic acid Traditional Name: 3,3-bis(4,5-dimethoxy-2-nitro-phenyl)propionic acid Formula: C19H20N2O10 MolecularWeight: 436.3695

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(CC(=O)O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(CC(=O)O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20N2O10/c1-28-15-5-11(13(20(24)25)8-17(15)30-3)10(7-19(22)23)12-6-16(29-2)18(31-4)9-14(12)21(26)27/h5-6,8-10H,7H2,1-4H3,(H,22,23)