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

Systemtic Name: (5S)-5-[4-(2-methylphenoxy)piperidin-1-yl]carbonyl-1-(3-morpholin-4-ium-4-ylpropyl)piperidin-2-one Openeye Name: (5S)-5-[4-(2-methylphenoxy)piperidine-1-carbonyl]-1-(3-morpholin-4-ium-4-ylpropyl)piperidin-2-one CAS Name: (5S)-5-[[4-(2-methylphenoxy)-1-piperidinyl]-oxomethyl]-1-[3-(4-morpholin-4-iumyl)propyl]-2-piperidinone IUPAC Name: (5S)-5-[4-(2-methylphenoxy)piperidine-1-carbonyl]-1-(3-morpholin-4-ium-4-ylpropyl)piperidin-2-one Traditional Name: (5S)-5-[4-(2-methylphenoxy)piperidine-1-carbonyl]-1-(3-morpholin-4-ium-4-ylpropyl)-2-piperidone Formula: C25H38N3O4+ MolecularWeight: 444.58692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC2CCN(CC2)C(=O)C3CCC(=O)N(C3)CCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1OC2CCN(CC2)C(=O)[C@H]3CCC(=O)N(C3)CCC[NH+]4CCOCC4

InChI

InChI=1S/C25H37N3O4/c1-20-5-2-3-6-23(20)32-22-9-13-27(14-10-22)25(30)21-7-8-24(29)28(19-21)12-4-11-26-15-17-31-18-16-26/h2-3,5-6,21-22H,4,7-19H2,1H3/p+1/t21-/m0/s1