(3S,4S)-1-[1-(1,3-benzodioxol-5-yl)piperidin-4-yl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol

Systemtic Name: (3S,4S)-1-[1-(1,3-benzodioxol-5-yl)piperidin-4-yl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[1-(1,3-benzodioxol-5-yl)-4-piperidyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-1-[1-(1,3-benzodioxol-5-yl)-4-piperidinyl]-4-(4-morpholinyl)-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-1-[1-(1,3-benzodioxol-5-yl)piperidin-4-yl]-4-morpholin-4-ylpyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-[1-(1,3-benzodioxol-5-yl)-4-piperidyl]-4-morpholino-pyrrolidin-1-ium-3-ol Formula: C20H30N3O4+ MolecularWeight: 376.4699

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CC(C(C2)O)N3CCOCC3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(CCC1[NH+]2C[C@@H]([C@H](C2)O)N3CCOCC3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H29N3O4/c24-18-13-23(12-17(18)22-7-9-25-10-8-22)15-3-5-21(6-4-15)16-1-2-19-20(11-16)27-14-26-19/h1-2,11,15,17-18,24H,3-10,12-14H2/p+1/t17-,18-/m0/s1