2-[(3-azanyl-3-oxidanylidene-propyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid

Systemtic Name: 2-[(3-azanyl-3-oxidanylidene-propyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Openeye Name: 2-[(3-amino-3-oxo-propyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid CAS Name: 2-[[(3-amino-3-oxopropyl)amino]-oxomethyl]-3-bicyclo[2.2.1]hept-5-enecarboxylic acid IUPAC Name: 2-[(3-amino-3-oxopropyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Traditional Name: 2-[(3-amino-3-keto-propyl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC1C(C2C(=O)NCCC(=O)N)C(=O)O

Isomeric SMILES

C1C2C=CC1C(C2C(=O)NCCC(=O)N)C(=O)O

InChI

InChI=1S/C12H16N2O4/c13-8(15)3-4-14-11(16)9-6-1-2-7(5-6)10(9)12(17)18/h1-2,6-7,9-10H,3-5H2,(H2,13,15)(H,14,16)(H,17,18)