2-[2-azanyl-3-[2-(cyclopropylamino)phenyl]pyridin-1-ium-1-yl]ethanal chloride

Systemtic Name: 2-[2-azanyl-3-[2-(cyclopropylamino)phenyl]pyridin-1-ium-1-yl]ethanal chloride Openeye Name: 2-[2-amino-3-[2-(cyclopropylamino)phenyl]pyridin-1-ium-1-yl]acetaldehyde chloride CAS Name: 2-[2-amino-3-[2-(cyclopropylamino)phenyl]-1-pyridin-1-iumyl]acetaldehyde chloride IUPAC Name: 2-[2-amino-3-[2-(cyclopropylamino)phenyl]pyridin-1-ium-1-yl]acetaldehyde chloride Traditional Name: 2-[2-amino-3-[2-(cyclopropylamino)phenyl]pyridin-1-ium-1-yl]acetaldehyde chloride Formula: C16H18ClN3O MolecularWeight: 303.78662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=CC=CC=C2C3=C([N+](=CC=C3)CC=O)N.[Cl-]

Isomeric SMILES

C1CC1NC2=CC=CC=C2C3=C([N+](=CC=C3)CC=O)N.[Cl-]

InChI

InChI=1S/C16H17N3O.ClH/c17-16-14(5-3-9-19(16)10-11-20)13-4-1-2-6-15(13)18-12-7-8-12;/h1-6,9,11-12,17-18H,7-8,10H2;1H