1-(carboxymethyl)cyclohepta[b]pyrrol-1-ium-3-carboxylic acid

Systemtic Name: 1-(carboxymethyl)cyclohepta[b]pyrrol-1-ium-3-carboxylic acid Openeye Name: 1-(carboxymethyl)cyclohepta[b]pyrrol-1-ium-3-carboxylic acid CAS Name: 1-(carboxymethyl)-3-cyclohepta[b]pyrrol-1-iumcarboxylic acid IUPAC Name: 1-(carboxymethyl)cyclohepta[b]pyrrol-1-ium-3-carboxylic acid Traditional Name: 1-(carboxymethyl)cyclohepta[b]pyrrol-1-ium-3-carboxylic acid Formula: C12H10NO4+ MolecularWeight: 232.2121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=[N+](C=C2C(=O)O)CC(=O)O)C=C1

Isomeric SMILES

C1=CC=C2C(=[N+](C=C2C(=O)O)CC(=O)O)C=C1

InChI

InChI=1S/C12H9NO4/c14-11(15)7-13-6-9(12(16)17)8-4-2-1-3-5-10(8)13/h1-6H,7H2,(H-,14,15,16,17)/p+1