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

Systemtic Name: 2-[2-azanyl-3-[2-(cyclohexen-1-ylamino)phenyl]pyridin-1-ium-1-yl]ethanal chloride Openeye Name: 2-[2-amino-3-[2-(cyclohexen-1-ylamino)phenyl]pyridin-1-ium-1-yl]acetaldehyde chloride CAS Name: 2-[2-amino-3-[2-(1-cyclohexenylamino)phenyl]-1-pyridin-1-iumyl]acetaldehyde chloride IUPAC Name: 2-[2-amino-3-[2-(cyclohexen-1-ylamino)phenyl]pyridin-1-ium-1-yl]acetaldehyde chloride Traditional Name: 2-[2-amino-3-[2-(cyclohexen-1-ylamino)phenyl]pyridin-1-ium-1-yl]acetaldehyde chloride Formula: C19H22ClN3O MolecularWeight: 343.85048

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)NC2=CC=CC=C2C3=C([N+](=CC=C3)CC=O)N.[Cl-]

Isomeric SMILES

C1CCC(=CC1)NC2=CC=CC=C2C3=C([N+](=CC=C3)CC=O)N.[Cl-]

InChI

InChI=1S/C19H21N3O.ClH/c20-19-17(10-6-12-22(19)13-14-23)16-9-4-5-11-18(16)21-15-7-2-1-3-8-15;/h4-7,9-12,14,20-21H,1-3,8,13H2;1H