1-[4-[4-(phenylmethyl)piperidin-1-ium-1-yl]piperidin-1-yl]ethanone

Systemtic Name: 1-[4-[4-(phenylmethyl)piperidin-1-ium-1-yl]piperidin-1-yl]ethanone Openeye Name: 1-[4-(4-benzylpiperidin-1-ium-1-yl)-1-piperidyl]ethanone CAS Name: 1-[4-[4-(phenylmethyl)-1-piperidin-1-iumyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-(4-benzylpiperidin-1-ium-1-yl)piperidin-1-yl]ethanone Traditional Name: 1-[4-(4-benzylpiperidin-1-ium-1-yl)piperidino]ethanone Formula: C19H29N2O+ MolecularWeight: 301.44636

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1CCC(CC1)[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H28N2O/c1-16(22)20-13-9-19(10-14-20)21-11-7-18(8-12-21)15-17-5-3-2-4-6-17/h2-6,18-19H,7-15H2,1H3/p+1