(2S)-2-(2,2-diphenylethyl)-4-(1H-imidazol-3-ium-5-ylmethyl)morpholine

Systemtic Name: (2S)-2-(2,2-diphenylethyl)-4-(1H-imidazol-3-ium-5-ylmethyl)morpholine Openeye Name: (2S)-2-(2,2-diphenylethyl)-4-(1H-imidazol-3-ium-5-ylmethyl)morpholine CAS Name: (2S)-2-(2,2-diphenylethyl)-4-(1H-imidazol-3-ium-5-ylmethyl)morpholine IUPAC Name: (2S)-2-(2,2-diphenylethyl)-4-(1H-imidazol-3-ium-5-ylmethyl)morpholine Traditional Name: (2S)-2-(2,2-diphenylethyl)-4-(1H-imidazol-3-ium-5-ylmethyl)morpholine Formula: C22H26N3O+ MolecularWeight: 348.46134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1CC2=C[NH+]=CN2)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CO[C@H](CN1CC2=C[NH+]=CN2)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N3O/c1-3-7-18(8-4-1)22(19-9-5-2-6-10-19)13-21-16-25(11-12-26-21)15-20-14-23-17-24-20/h1-10,14,17,21-22H,11-13,15-16H2,(H,23,24)/p+1/t21-/m0/s1