2-[[(2-methylfuran-3-yl)carbonylamino]carbamoyl]bicyclo[2.2.2]oct-5-ene-3-carboxylic acid

Systemtic Name: 2-[[(2-methylfuran-3-yl)carbonylamino]carbamoyl]bicyclo[2.2.2]oct-5-ene-3-carboxylic acid Openeye Name: 2-[[(2-methylfuran-3-carbonyl)amino]carbamoyl]bicyclo[2.2.2]oct-5-ene-3-carboxylic acid CAS Name: 2-[[[(2-methyl-3-furanyl)-oxomethyl]hydrazo]-oxomethyl]-3-bicyclo[2.2.2]oct-5-enecarboxylic acid IUPAC Name: 2-[[(2-methylfuran-3-carbonyl)amino]carbamoyl]bicyclo[2.2.2]oct-5-ene-3-carboxylic acid Traditional Name: 2-[[(2-methyl-3-furoyl)amino]carbamoyl]bicyclo[2.2.2]oct-5-ene-3-carboxylic acid Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)NNC(=O)C2C3CCC(C2C(=O)O)C=C3

Isomeric SMILES

CC1=C(C=CO1)C(=O)NNC(=O)C2C3CCC(C2C(=O)O)C=C3

InChI

InChI=1S/C16H18N2O5/c1-8-11(6-7-23-8)14(19)17-18-15(20)12-9-2-4-10(5-3-9)13(12)16(21)22/h2,4,6-7,9-10,12-13H,3,5H2,1H3,(H,17,19)(H,18,20)(H,21,22)