3-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one

Systemtic Name: 3-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1-[4-(phenylmethyl)piperidin-1-yl]propan-1-one Openeye Name: 3-(1-benzylpiperidin-1-ium-4-yl)-1-(4-benzyl-1-piperidyl)propan-1-one CAS Name: 3-[1-(phenylmethyl)-4-piperidin-1-iumyl]-1-[4-(phenylmethyl)-1-piperidinyl]-1-propanone IUPAC Name: 3-(1-benzylpiperidin-1-ium-4-yl)-1-(4-benzylpiperidin-1-yl)propan-1-one Traditional Name: 3-(1-benzylpiperidin-1-ium-4-yl)-1-(4-benzylpiperidino)propan-1-one Formula: C27H37N2O+ MolecularWeight: 405.59548

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)N2CCC(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)N2CCC(CC2)CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H36N2O/c30-27(29-19-15-25(16-20-29)21-24-7-3-1-4-8-24)12-11-23-13-17-28(18-14-23)22-26-9-5-2-6-10-26/h1-10,23,25H,11-22H2/p+1