3-(2-azanyl-5-nitro-phenyl)carbonyloxirane-2-carboxylic acid

Systemtic Name: 3-(2-azanyl-5-nitro-phenyl)carbonyloxirane-2-carboxylic acid Openeye Name: 3-(2-amino-5-nitro-benzoyl)oxirane-2-carboxylic acid CAS Name: 3-[(2-amino-5-nitrophenyl)-oxomethyl]-2-oxiranecarboxylic acid IUPAC Name: 3-(2-amino-5-nitrobenzoyl)oxirane-2-carboxylic acid Traditional Name: 3-(2-amino-5-nitro-benzoyl)oxirane-2-carboxylic acid Formula: C10H8N2O6 MolecularWeight: 252.18032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)C2C(O2)C(=O)O)N

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C(=O)C2C(O2)C(=O)O)N

InChI

InChI=1S/C10H8N2O6/c11-6-2-1-4(12(16)17)3-5(6)7(13)8-9(18-8)10(14)15/h1-3,8-9H,11H2,(H,14,15)