azocan-1-yl-[(3S,6S)-6-methylpiperidin-1-ium-3-yl]methanone

Systemtic Name: azocan-1-yl-[(3S,6S)-6-methylpiperidin-1-ium-3-yl]methanone Openeye Name: azocan-1-yl-[(3S,6S)-6-methylpiperidin-1-ium-3-yl]methanone CAS Name: 1-azocanyl-[(3S,6S)-6-methyl-3-piperidin-1-iumyl]methanone IUPAC Name: azocan-1-yl-[(3S,6S)-6-methylpiperidin-1-ium-3-yl]methanone Traditional Name: azocan-1-yl-[(3S,6S)-6-methylpiperidin-1-ium-3-yl]methanone Formula: C14H27N2O+ MolecularWeight: 239.37698

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C[NH2+]1)C(=O)N2CCCCCCC2

Isomeric SMILES

C[C@H]1CC[C@@H](C[NH2+]1)C(=O)N2CCCCCCC2

InChI

InChI=1S/C14H26N2O/c1-12-7-8-13(11-15-12)14(17)16-9-5-3-2-4-6-10-16/h12-13,15H,2-11H2,1H3/p+1/t12-,13-/m0/s1