5-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2,2-dimethyl-3-thiophen-2-yl-1,2-oxazolidin-2-ium

Systemtic Name: 5-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2,2-dimethyl-3-thiophen-2-yl-1,2-oxazolidin-2-ium Openeye Name: 5-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2,2-dimethyl-3-(2-thienyl)isoxazolidin-2-ium CAS Name: 5-(4-chlorophenyl)-3-(1-imidazolylmethyl)-2,2-dimethyl-3-thiophen-2-ylisoxazolidin-2-ium IUPAC Name: 5-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2,2-dimethyl-3-thiophen-2-yl-1,2-oxazolidin-2-ium Traditional Name: 5-(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2,2-dimethyl-3-(2-thienyl)isoxazolidin-2-ium Formula: C19H21ClN3OS+ MolecularWeight: 374.90754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(CC(O1)C2=CC=C(C=C2)Cl)(CN3C=CN=C3)C4=CC=CS4)C

Isomeric SMILES

C[N+]1(C(CC(O1)C2=CC=C(C=C2)Cl)(CN3C=CN=C3)C4=CC=CS4)C

InChI

InChI=1S/C19H21ClN3OS/c1-23(2)19(18-4-3-11-25-18,13-22-10-9-21-14-22)12-17(24-23)15-5-7-16(20)8-6-15/h3-11,14,17H,12-13H2,1-2H3/q+1