(3S,4S)-4-morpholin-4-yl-1-[(4-phenylmethoxyphenyl)methyl]pyrrolidin-1-ium-3-ol

Systemtic Name: (3S,4S)-4-morpholin-4-yl-1-[(4-phenylmethoxyphenyl)methyl]pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[(4-benzyloxyphenyl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-4-(4-morpholinyl)-1-[(4-phenylmethoxyphenyl)methyl]-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-4-morpholin-4-yl-1-[(4-phenylmethoxyphenyl)methyl]pyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-(4-benzoxybenzyl)-4-morpholino-pyrrolidin-1-ium-3-ol Formula: C22H29N2O3+ MolecularWeight: 369.47726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2C[NH+](CC2O)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1COCCN1[C@H]2C[NH+](C[C@@H]2O)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C22H28N2O3/c25-22-16-23(15-21(22)24-10-12-26-13-11-24)14-18-6-8-20(9-7-18)27-17-19-4-2-1-3-5-19/h1-9,21-22,25H,10-17H2/p+1/t21-,22-/m0/s1