2-methyl-1-oxidanidyl-3-oxidanyl-4,5,6,7-tetrahydro-3aH-benzimidazol-1-ium-2-carboxylic acid

Systemtic Name: 2-methyl-1-oxidanidyl-3-oxidanyl-4,5,6,7-tetrahydro-3aH-benzimidazol-1-ium-2-carboxylic acid Openeye Name: 3-hydroxy-2-methyl-1-oxido-4,5,6,7-tetrahydro-3aH-benzimidazol-1-ium-2-carboxylic acid CAS Name: 3-hydroxy-2-methyl-1-oxido-4,5,6,7-tetrahydro-3aH-benzimidazol-1-ium-2-carboxylic acid IUPAC Name: 3-hydroxy-2-methyl-1-oxido-4,5,6,7-tetrahydro-3aH-benzimidazol-1-ium-2-carboxylic acid Traditional Name: 3-hydroxy-2-methyl-1-oxido-4,5,6,7-tetrahydro-3aH-benzimidazol-1-ium-2-carboxylic acid Formula: C9H14N2O4 MolecularWeight: 214.21846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C2CCCCC2=[N+]1[O-])O)C(=O)O

Isomeric SMILES

CC1(N(C2CCCCC2=[N+]1[O-])O)C(=O)O

InChI

InChI=1S/C9H14N2O4/c1-9(8(12)13)10(14)6-4-2-3-5-7(6)11(9)15/h6,14H,2-5H2,1H3,(H,12,13)