(2S,6S)-2,6-bis(piperidin-1-ium-1-ylmethyl)cyclohexan-1-one

Systemtic Name: (2S,6S)-2,6-bis(piperidin-1-ium-1-ylmethyl)cyclohexan-1-one Openeye Name: (2S,6S)-2,6-bis(piperidin-1-ium-1-ylmethyl)cyclohexanone CAS Name: (2S,6S)-2,6-bis(1-piperidin-1-iumylmethyl)-1-cyclohexanone IUPAC Name: (2S,6S)-2,6-bis(piperidin-1-ium-1-ylmethyl)cyclohexan-1-one Traditional Name: (2S,6S)-2,6-bis(piperidin-1-ium-1-ylmethyl)cyclohexanone Formula: C18H34N2O+2 MolecularWeight: 294.47536

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2CCCC(C2=O)C[NH+]3CCCCC3

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H]2CCC[C@H](C2=O)C[NH+]3CCCCC3

InChI

InChI=1S/C18H32N2O/c21-18-16(14-19-10-3-1-4-11-19)8-7-9-17(18)15-20-12-5-2-6-13-20/h16-17H,1-15H2/p+2/t16-,17-/m0/s1