2-[[(3-nitrophenyl)carbonylamino]carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid

Systemtic Name: 2-[[(3-nitrophenyl)carbonylamino]carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid Openeye Name: 2-[[(3-nitrobenzoyl)amino]carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid CAS Name: 2-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-oxomethyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid IUPAC Name: 2-[[(3-nitrobenzoyl)amino]carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid Traditional Name: 2-[[(3-nitrobenzoyl)amino]carbamoyl]-7-oxabicyclo[2.2.1]heptane-3-carboxylic acid Formula: C15H15N3O7 MolecularWeight: 349.2955

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C(C1O2)C(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CC2C(C(C1O2)C(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H15N3O7/c19-13(7-2-1-3-8(6-7)18(23)24)16-17-14(20)11-9-4-5-10(25-9)12(11)15(21)22/h1-3,6,9-12H,4-5H2,(H,16,19)(H,17,20)(H,21,22)