3,4,5-trimethoxy-N-[3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-yl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[3-(1-phenylpropan-2-yl)-1,2,3-oxadiazol-3-ium-5-yl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-yl]benzamide CAS Name: 3,4,5-trimethoxy-N-[3-(1-phenylpropan-2-yl)-5-oxadiazol-3-iumyl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[3-(1-phenylpropan-2-yl)oxadiazol-3-ium-5-yl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[3-(1-methyl-2-phenyl-ethyl)oxadiazol-3-ium-5-yl]benzamide Formula: C21H24N3O5+ MolecularWeight: 398.43236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)[N+]2=NOC(=C2)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC(CC1=CC=CC=C1)[N+]2=NOC(=C2)NC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H23N3O5/c1-14(10-15-8-6-5-7-9-15)24-13-19(29-23-24)22-21(25)16-11-17(26-2)20(28-4)18(12-16)27-3/h5-9,11-14H,10H2,1-4H3/p+1