1-methyl-4-piperidin-1-ium-4-yl-1,4-diazepan-1-ium

Systemtic Name: 1-methyl-4-piperidin-1-ium-4-yl-1,4-diazepan-1-ium Openeye Name: 1-methyl-4-piperidin-1-ium-4-yl-1,4-diazepan-1-ium CAS Name: 1-methyl-4-(4-piperidin-1-iumyl)-1,4-diazepan-1-ium IUPAC Name: 1-methyl-4-piperidin-1-ium-4-yl-1,4-diazepan-1-ium Traditional Name: 1-methyl-4-piperidin-1-ium-4-yl-1,4-diazepan-1-ium Formula: C11H25N3+2 MolecularWeight: 199.3363

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)C2CC[NH2+]CC2

Isomeric SMILES

C[NH+]1CCCN(CC1)C2CC[NH2+]CC2

InChI

InChI=1S/C11H23N3/c1-13-7-2-8-14(10-9-13)11-3-5-12-6-4-11/h11-12H,2-10H2,1H3/p+2