1-methyl-4-(1-methylpiperidin-1-ium-4-yl)-1,4-diazepan-1-ium

Systemtic Name: 1-methyl-4-(1-methylpiperidin-1-ium-4-yl)-1,4-diazepan-1-ium Openeye Name: 1-methyl-4-(1-methylpiperidin-1-ium-4-yl)-1,4-diazepan-1-ium CAS Name: 1-methyl-4-(1-methyl-4-piperidin-1-iumyl)-1,4-diazepan-1-ium IUPAC Name: 1-methyl-4-(1-methylpiperidin-1-ium-4-yl)-1,4-diazepan-1-ium Traditional Name: 1-methyl-4-(1-methylpiperidin-1-ium-4-yl)-1,4-diazepan-1-ium Formula: C12H27N3+2 MolecularWeight: 213.36288

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C2CC[NH+](CC2)C

Isomeric SMILES

C[NH+]1CCCN(CC1)C2CC[NH+](CC2)C

InChI

InChI=1S/C12H25N3/c1-13-6-3-7-15(11-10-13)12-4-8-14(2)9-5-12/h12H,3-11H2,1-2H3/p+2