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

Systemtic Name: [3-ethynyl-5-(hydroxymethyl)-2-nitro-phenyl]carbamic acid Openeye Name: [3-ethynyl-5-(hydroxymethyl)-2-nitro-phenyl]carbamic acid CAS Name: [3-ethynyl-5-(hydroxymethyl)-2-nitrophenyl]carbamic acid IUPAC Name: [3-ethynyl-5-(hydroxymethyl)-2-nitrophenyl]carbamic acid Traditional Name: (3-ethynyl-5-methylol-2-nitro-phenyl)carbamic acid Formula: C10H8N2O5 MolecularWeight: 236.18092

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC(=C1[N+](=O)[O-])NC(=O)O)CO

Isomeric SMILES

C#CC1=CC(=CC(=C1[N+](=O)[O-])NC(=O)O)CO

InChI

InChI=1S/C10H8N2O5/c1-2-7-3-6(5-13)4-8(11-10(14)15)9(7)12(16)17/h1,3-4,11,13H,5H2,(H,14,15)