3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenyl-hex-5-enyl]-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenyl-hex-5-enyl]-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenyl-hex-5-enyl]-2H-oxadiazol-3-ium-5-one CAS Name: 3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenylhex-5-enyl]-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenylhex-5-enyl]-2H-oxadiazol-3-ium-5-one Traditional Name: 3-[3-(dimethylamino)propyl]-4-[(E)-1-methoxy-3-methyl-6-phenyl-hex-5-enyl]-2H-oxadiazol-3-ium-5-one Formula: C21H32N3O3+ MolecularWeight: 374.49708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC1=CC=CC=C1)CC(C2=[N+](NOC2=O)CCCN(C)C)OC

Isomeric SMILES

CC(C/C=C/C1=CC=CC=C1)CC(C2=[N+](NOC2=O)CCCN(C)C)OC

InChI

InChI=1S/C21H31N3O3/c1-17(10-8-13-18-11-6-5-7-12-18)16-19(26-4)20-21(25)27-22-24(20)15-9-14-23(2)3/h5-8,11-13,17,19H,9-10,14-16H2,1-4H3/p+1/b13-8+