(2S)-1-morpholin-4-ium-4-yl-3-[4-(2-phenylpropan-2-yl)phenoxy]propan-2-ol

Systemtic Name: (2S)-1-morpholin-4-ium-4-yl-3-[4-(2-phenylpropan-2-yl)phenoxy]propan-2-ol Openeye Name: (2S)-1-[4-(1-methyl-1-phenyl-ethyl)phenoxy]-3-morpholin-4-ium-4-yl-propan-2-ol CAS Name: (2S)-1-(4-morpholin-4-iumyl)-3-[4-(2-phenylpropan-2-yl)phenoxy]-2-propanol IUPAC Name: (2S)-1-morpholin-4-ium-4-yl-3-[4-(2-phenylpropan-2-yl)phenoxy]propan-2-ol Traditional Name: (2S)-1-(4-cumylphenoxy)-3-morpholin-4-ium-4-yl-propan-2-ol Formula: C22H30NO3+ MolecularWeight: 356.4785

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC(C[NH+]3CCOCC3)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC[C@H](C[NH+]3CCOCC3)O

InChI

InChI=1S/C22H29NO3/c1-22(2,18-6-4-3-5-7-18)19-8-10-21(11-9-19)26-17-20(24)16-23-12-14-25-15-13-23/h3-11,20,24H,12-17H2,1-2H3/p+1/t20-/m0/s1