[5-(dimethylamino)-3-ethynyl-2-nitro-phenyl]carbamic acid

Systemtic Name: [5-(dimethylamino)-3-ethynyl-2-nitro-phenyl]carbamic acid Openeye Name: [5-(dimethylamino)-3-ethynyl-2-nitro-phenyl]carbamic acid CAS Name: [5-(dimethylamino)-3-ethynyl-2-nitrophenyl]carbamic acid IUPAC Name: [5-(dimethylamino)-3-ethynyl-2-nitrophenyl]carbamic acid Traditional Name: [5-(dimethylamino)-3-ethynyl-2-nitro-phenyl]carbamic acid Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O4/c1-4-7-5-8(13(2)3)6-9(12-11(15)16)10(7)14(17)18/h1,5-6,12H,2-3H3,(H,15,16)