(6-chloranylpyridin-3-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: (6-chloranylpyridin-3-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Openeye Name: (6-chloro-3-pyridyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone CAS Name: (6-chloro-3-pyridinyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone IUPAC Name: (6-chloropyridin-3-yl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Traditional Name: (6-chloro-3-pyridyl)-(4-methyl-1,4-diazepan-4-ium-1-yl)methanone Formula: C12H17ClN3O+ MolecularWeight: 254.73588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16ClN3O/c1-15-5-2-6-16(8-7-15)12(17)10-3-4-11(13)14-9-10/h3-4,9H,2,5-8H2,1H3/p+1