(5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-phenethylpiperidin-1-yl)carbonyl-piperidin-2-one

Systemtic Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-phenethylpiperidin-1-yl)carbonyl-piperidin-2-one Openeye Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-phenethylpiperidine-1-carbonyl)piperidin-2-one CAS Name: (5S)-1-[3-(4-morpholin-4-iumyl)propyl]-5-[oxo-(4-phenethyl-1-piperidinyl)methyl]-2-piperidinone IUPAC Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-phenethylpiperidine-1-carbonyl)piperidin-2-one Traditional Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-(4-phenethylpiperidine-1-carbonyl)-2-piperidone Formula: C26H40N3O3+ MolecularWeight: 442.6141

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)N2CCC(CC2)CCC3=CC=CC=C3)CCC[NH+]4CCOCC4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)N2CCC(CC2)CCC3=CC=CC=C3)CCC[NH+]4CCOCC4

InChI

InChI=1S/C26H39N3O3/c30-25-10-9-24(21-29(25)14-4-13-27-17-19-32-20-18-27)26(31)28-15-11-23(12-16-28)8-7-22-5-2-1-3-6-22/h1-3,5-6,23-24H,4,7-21H2/p+1/t24-/m0/s1