1-morpholin-4-yl-3-[1-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]piperidin-4-yl]propan-1-one

Systemtic Name: 1-morpholin-4-yl-3-[1-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]piperidin-4-yl]propan-1-one Openeye Name: 3-[1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-piperidyl]-1-morpholino-propan-1-one CAS Name: 1-(4-morpholinyl)-3-[1-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-4-piperidinyl]-1-propanone IUPAC Name: 3-[1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]piperidin-4-yl]-1-morpholin-4-ylpropan-1-one Traditional Name: 3-[1-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-4-piperidyl]-1-morpholino-propan-1-one Formula: C23H36N3O2+ MolecularWeight: 386.55084

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1N2CCC(CC2)CCC(=O)N3CCOCC3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C[C@H]1N2CCC(CC2)CCC(=O)N3CCOCC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H35N3O2/c27-23(26-14-16-28-17-15-26)7-6-20-8-12-25(13-9-20)22-10-11-24(19-22)18-21-4-2-1-3-5-21/h1-5,20,22H,6-19H2/p+1/t22-/m0/s1