(2S)-2-phenethyl-4-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]morpholin-4-ium

Systemtic Name: (2S)-2-phenethyl-4-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]morpholin-4-ium Openeye Name: (2S)-2-phenethyl-4-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]morpholin-4-ium CAS Name: (2S)-2-phenethyl-4-[1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]morpholin-4-ium IUPAC Name: (2S)-2-phenethyl-4-[1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]morpholin-4-ium Traditional Name: (2S)-2-phenethyl-4-[1-(3-pyridylmethyl)piperidin-1-ium-4-yl]morpholin-4-ium Formula: C23H33N3O+2 MolecularWeight: 367.52762

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CCOC(C2)CCC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CCO[C@H](C2)CCC3=CC=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C23H31N3O/c1-2-5-20(6-3-1)8-9-23-19-26(15-16-27-23)22-10-13-25(14-11-22)18-21-7-4-12-24-17-21/h1-7,12,17,22-23H,8-11,13-16,18-19H2/p+2/t23-/m0/s1