1-(azepan-1-yl)-2-[2-[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2-[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy]ethanone Openeye Name: 1-(azepan-1-yl)-2-[2-[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy]ethanone CAS Name: 1-(1-azepanyl)-2-[2-[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[2-[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy]ethanone Traditional Name: 1-(azepan-1-yl)-2-[2-[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenoxy]ethanone Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC2=CC=CC=C2C3=NOC(=N3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)COC2=CC=CC=C2C3=NOC(=N3)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H22ClN3O3/c23-18-11-5-3-9-16(18)22-24-21(25-29-22)17-10-4-6-12-19(17)28-15-20(27)26-13-7-1-2-8-14-26/h3-6,9-12H,1-2,7-8,13-15H2