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

Systemtic Name: (5S)-1-(3-morpholin-4-ium-4-ylpropyl)-5-[4-(phenylmethyl)piperidin-1-yl]carbonyl-piperidin-2-one Openeye Name: (5S)-5-(4-benzylpiperidine-1-carbonyl)-1-(3-morpholin-4-ium-4-ylpropyl)piperidin-2-one CAS Name: (5S)-1-[3-(4-morpholin-4-iumyl)propyl]-5-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-2-piperidinone IUPAC Name: (5S)-5-(4-benzylpiperidine-1-carbonyl)-1-(3-morpholin-4-ium-4-ylpropyl)piperidin-2-one Traditional Name: (5S)-5-(4-benzylpiperidine-1-carbonyl)-1-(3-morpholin-4-ium-4-ylpropyl)-2-piperidone Formula: C25H38N3O3+ MolecularWeight: 428.58752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CC1C(=O)N2CCC(CC2)CC3=CC=CC=C3)CCC[NH+]4CCOCC4

Isomeric SMILES

C1CC(=O)N(C[C@H]1C(=O)N2CCC(CC2)CC3=CC=CC=C3)CCC[NH+]4CCOCC4

InChI

InChI=1S/C25H37N3O3/c29-24-8-7-23(20-28(24)12-4-11-26-15-17-31-18-16-26)25(30)27-13-9-22(10-14-27)19-21-5-2-1-3-6-21/h1-3,5-6,22-23H,4,7-20H2/p+1/t23-/m0/s1