2-[[(3-nitrophenyl)carbonylamino]carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[[(3-nitrophenyl)carbonylamino]carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[[(3-nitrobenzoyl)amino]carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-oxomethyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-[[(3-nitrobenzoyl)amino]carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[[(3-nitrobenzoyl)amino]carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C16H15N3O6 MolecularWeight: 345.3068

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC1C(C2C(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1C2C=CC1C(C2C(=O)NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H15N3O6/c20-14(10-2-1-3-11(7-10)19(24)25)17-18-15(21)12-8-4-5-9(6-8)13(12)16(22)23/h1-5,7-9,12-13H,6H2,(H,17,20)(H,18,21)(H,22,23)