piperidin-1-yl-[(3S)-1-(pyridin-4-ylmethyl)piperidin-1-ium-3-yl]methanone

Systemtic Name: piperidin-1-yl-[(3S)-1-(pyridin-4-ylmethyl)piperidin-1-ium-3-yl]methanone Openeye Name: 1-piperidyl-[(3S)-1-(4-pyridylmethyl)piperidin-1-ium-3-yl]methanone CAS Name: 1-piperidinyl-[(3S)-1-(pyridin-4-ylmethyl)-3-piperidin-1-iumyl]methanone IUPAC Name: piperidin-1-yl-[(3S)-1-(pyridin-4-ylmethyl)piperidin-1-ium-3-yl]methanone Traditional Name: piperidino-[(3S)-1-(4-pyridylmethyl)piperidin-1-ium-3-yl]methanone Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCC[NH+](C2)CC3=CC=NC=C3

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H]2CCC[NH+](C2)CC3=CC=NC=C3

InChI

InChI=1S/C17H25N3O/c21-17(20-11-2-1-3-12-20)16-5-4-10-19(14-16)13-15-6-8-18-9-7-15/h6-9,16H,1-5,10-14H2/p+1/t16-/m0/s1