6-oxidanidyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium-11-carboxylic acid hydrochloride

Systemtic Name: 6-oxidanidyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium-11-carboxylic acid hydrochloride Openeye Name: 6-oxido-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium-11-carboxylic acid hydrochloride CAS Name: 6-oxido-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium-11-carboxylic acid hydrochloride IUPAC Name: 6-oxido-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium-11-carboxylic acid hydrochloride Traditional Name: 6-oxido-2,3,4,5-tetrahydro-1H-azepino[4,5-b]quinolin-6-ium-11-carboxylic acid hydrochloride Formula: C14H15ClN2O3 MolecularWeight: 294.7335

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC2=[N+](C3=CC=CC=C3C(=C21)C(=O)O)[O-].Cl

Isomeric SMILES

C1CNCCC2=[N+](C3=CC=CC=C3C(=C21)C(=O)O)[O-].Cl

InChI

InChI=1S/C14H14N2O3.ClH/c17-14(18)13-9-3-1-2-4-11(9)16(19)12-6-8-15-7-5-10(12)13;/h1-4,15H,5-8H2,(H,17,18);1H