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

Systemtic Name: 4-[1-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-yl]morpholin-4-ium Openeye Name: 4-[1-(1-benzylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]morpholin-4-ium CAS Name: 4-[1-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-piperidin-1-iumyl]morpholin-4-ium IUPAC Name: 4-[1-(1-benzylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]morpholin-4-ium Traditional Name: 4-[1-(1-benzylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]morpholin-4-ium Formula: C21H36N3O+3 MolecularWeight: 346.53004

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CCC(CC2)[NH+]3CCOCC3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CCC(CC2)[NH+]3CCOCC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H33N3O/c1-2-4-19(5-3-1)18-22-10-6-20(7-11-22)23-12-8-21(9-13-23)24-14-16-25-17-15-24/h1-5,20-21H,6-18H2/p+3