4-chloranyl-N,N-dihexyl-6-methyl-1-oxidanidyl-pyridin-1-ium-2-amine

Systemtic Name: 4-chloranyl-N,N-dihexyl-6-methyl-1-oxidanidyl-pyridin-1-ium-2-amine Openeye Name: 4-chloro-N,N-dihexyl-6-methyl-1-oxido-pyridin-1-ium-2-amine CAS Name: 4-chloro-N,N-dihexyl-6-methyl-1-oxido-2-pyridin-1-iumamine IUPAC Name: 4-chloro-N,N-dihexyl-6-methyl-1-oxidopyridin-1-ium-2-amine Traditional Name: (4-chloro-6-methyl-1-oxido-pyridin-1-ium-2-yl)-dihexyl-amine Formula: C18H31ClN2O MolecularWeight: 326.90454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C1=CC(=CC(=[N+]1[O-])C)Cl

Isomeric SMILES

CCCCCCN(CCCCCC)C1=CC(=CC(=[N+]1[O-])C)Cl

InChI

InChI=1S/C18H31ClN2O/c1-4-6-8-10-12-20(13-11-9-7-5-2)18-15-17(19)14-16(3)21(18)22/h14-15H,4-13H2,1-3H3