[3,6-bis(chloranyl)pyridin-2-yl]-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: [3,6-bis(chloranyl)pyridin-2-yl]-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (3,6-dichloro-2-pyridyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (3,6-dichloro-2-pyridinyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (3,6-dichloropyridin-2-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (3,6-dichloro-2-pyridyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C12H16Cl2N3O+ MolecularWeight: 289.18094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C(=O)C2=C(C=CC(=N2)Cl)Cl

Isomeric SMILES

C[NH+]1CCCN(CC1)C(=O)C2=C(C=CC(=N2)Cl)Cl

InChI

InChI=1S/C12H15Cl2N3O/c1-16-5-2-6-17(8-7-16)12(18)11-9(13)3-4-10(14)15-11/h3-4H,2,5-8H2,1H3/p+1