(2S)-2-[(3S)-piperidin-1-ium-3-yl]azepan-1-ium

Systemtic Name: (2S)-2-[(3S)-piperidin-1-ium-3-yl]azepan-1-ium Openeye Name: (2S)-2-[(3S)-piperidin-1-ium-3-yl]azepan-1-ium CAS Name: (2S)-2-[(3S)-3-piperidin-1-iumyl]azepan-1-ium IUPAC Name: (2S)-2-[(3S)-piperidin-1-ium-3-yl]azepan-1-ium Traditional Name: (2S)-2-[(3S)-piperidin-1-ium-3-yl]azepan-1-ium Formula: C11H24N2+2 MolecularWeight: 184.32166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC([NH2+]CC1)C2CCC[NH2+]C2

Isomeric SMILES

C1CC[C@H]([NH2+]CC1)[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C11H22N2/c1-2-6-11(13-8-3-1)10-5-4-7-12-9-10/h10-13H,1-9H2/p+2/t10-,11-/m0/s1