1-(azepan-1-yl)-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propan-1-one

Systemtic Name: 1-(azepan-1-yl)-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propan-1-one Openeye Name: 1-(azepan-1-yl)-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propan-1-one CAS Name: 1-(1-azepanyl)-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-propanone IUPAC Name: 1-(azepan-1-yl)-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propan-1-one Traditional Name: 1-(azepan-1-yl)-3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propan-1-one Formula: C17H20ClN3O2 MolecularWeight: 333.8126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCC2=NC(=NO2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)CCC2=NC(=NO2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H20ClN3O2/c18-14-7-5-13(6-8-14)17-19-15(23-20-17)9-10-16(22)21-11-3-1-2-4-12-21/h5-8H,1-4,9-12H2