4-(carboxymethyl)-4-(2,3-dihydro-1H-inden-2-yloxycarbonyl)-1-oxidanidyl-imidazol-1-ium-2-carboxylate

Systemtic Name: 4-(carboxymethyl)-4-(2,3-dihydro-1H-inden-2-yloxycarbonyl)-1-oxidanidyl-imidazol-1-ium-2-carboxylate Openeye Name: 4-(carboxymethyl)-4-indan-2-yloxycarbonyl-1-oxido-imidazol-1-ium-2-carboxylate CAS Name: 4-(carboxymethyl)-4-[2,3-dihydro-1H-inden-2-yloxy(oxo)methyl]-1-oxido-2-imidazol-1-iumcarboxylate IUPAC Name: 4-(carboxymethyl)-4-(2,3-dihydro-1H-inden-2-yloxycarbonyl)-1-oxidoimidazol-1-ium-2-carboxylate Traditional Name: 4-(carboxymethyl)-4-indan-2-yloxycarbonyl-1-oxido-imidazol-1-ium-2-carboxylate Formula: C16H13N2O7- MolecularWeight: 345.28362

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=CC=CC=C21)OC(=O)C3(C=[N+](C(=N3)C(=O)[O-])[O-])CC(=O)O

Isomeric SMILES

C1C(CC2=CC=CC=C21)OC(=O)C3(C=[N+](C(=N3)C(=O)[O-])[O-])CC(=O)O

InChI

InChI=1S/C16H14N2O7/c19-12(20)7-16(8-18(24)13(17-16)14(21)22)15(23)25-11-5-9-3-1-2-4-10(9)6-11/h1-4,8,11H,5-7H2,(H,19,20)(H,21,22)/p-1