[(5R)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [(5R)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [(5R)-3-(3-bromophenyl)-4,5-dihydroisoxazol-5-yl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [(5R)-3-(3-bromophenyl)-4,5-dihydroisoxazol-5-yl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [(5R)-3-(3-bromophenyl)-4,5-dihydro-1,2-oxazol-5-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [(5R)-3-(3-bromophenyl)-2-isoxazolin-5-yl]-(4-phenylpiperazino)methanone Formula: C20H20BrN3O2 MolecularWeight: 414.2957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3CC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)[C@H]3CC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H20BrN3O2/c21-16-6-4-5-15(13-16)18-14-19(26-22-18)20(25)24-11-9-23(10-12-24)17-7-2-1-3-8-17/h1-8,13,19H,9-12,14H2/t19-/m1/s1