5-[[2-(dimethylamino)-2-oxidanylidene-ethyl]amino]-2-nitro-benzoic acid

Systemtic Name: 5-[[2-(dimethylamino)-2-oxidanylidene-ethyl]amino]-2-nitro-benzoic acid Openeye Name: 5-[[2-(dimethylamino)-2-oxo-ethyl]amino]-2-nitro-benzoic acid CAS Name: 5-[[2-(dimethylamino)-2-oxoethyl]amino]-2-nitrobenzoic acid IUPAC Name: 5-[[2-(dimethylamino)-2-oxoethyl]amino]-2-nitrobenzoic acid Traditional Name: 5-[[2-(dimethylamino)-2-keto-ethyl]amino]-2-nitro-benzoic acid Formula: C11H13N3O5 MolecularWeight: 267.23802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CNC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CN(C)C(=O)CNC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H13N3O5/c1-13(2)10(15)6-12-7-3-4-9(14(18)19)8(5-7)11(16)17/h3-5,12H,6H2,1-2H3,(H,16,17)