bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid; 2,6-dimethyl-1-oxidanidyl-pyridin-1-ium

Systemtic Name: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid; 2,6-dimethyl-1-oxidanidyl-pyridin-1-ium Openeye Name: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid; 2,6-dimethyl-1-oxido-pyridin-1-ium CAS Name: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid; 2,6-dimethyl-1-oxidopyridin-1-ium IUPAC Name: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid; 2,6-dimethyl-1-oxidopyridin-1-ium Traditional Name: bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid; 2,6-dimethyl-1-oxido-pyridin-1-ium Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=CC=C1)C)[O-].C1C2C=CC1C(C2C(=O)O)C(=O)O

Isomeric SMILES

CC1=[N+](C(=CC=C1)C)[O-].C1C2C=CC1C(C2C(=O)O)C(=O)O

InChI

InChI=1S/C9H10O4.C7H9NO/c10-8(11)6-4-1-2-5(3-4)7(6)9(12)13;1-6-4-3-5-7(2)8(6)9/h1-2,4-7H,3H2,(H,10,11)(H,12,13);3-5H,1-2H3