1-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenyl-butan-1-one

Systemtic Name: 1-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenyl-butan-1-one Openeye Name: 1-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenyl-butan-1-one CAS Name: 1-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-1-pyrrolidinyl]-2-phenyl-1-butanone IUPAC Name: 1-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-2-phenylbutan-1-one Traditional Name: 1-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidino]-2-phenyl-butan-1-one Formula: C22H22BrN3O2 MolecularWeight: 440.33298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCCC2C3=NC(=NO3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCCC2C3=NC(=NO3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H22BrN3O2/c1-2-18(15-7-4-3-5-8-15)22(27)26-14-6-9-19(26)21-24-20(25-28-21)16-10-12-17(23)13-11-16/h3-5,7-8,10-13,18-19H,2,6,9,14H2,1H3