4-(2-dimethylaminoethyloxy)-5-methoxy-2-nitro-benzoic acid

Systemtic Name: 4-(2-dimethylaminoethyloxy)-5-methoxy-2-nitro-benzoic acid Openeye Name: 4-(2-dimethylaminoethyloxy)-5-methoxy-2-nitro-benzoic acid CAS Name: 4-(2-dimethylaminoethyloxy)-5-methoxy-2-nitrobenzoic acid IUPAC Name: 4-(2-dimethylaminoethyloxy)-5-methoxy-2-nitrobenzoic acid Traditional Name: 4-(2-dimethylaminoethyloxy)-5-methoxy-2-nitro-benzoic acid Formula: C12H16N2O6 MolecularWeight: 284.26524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O6/c1-13(2)4-5-20-11-7-9(14(17)18)8(12(15)16)6-10(11)19-3/h6-7H,4-5H2,1-3H3,(H,15,16)