5-(3,4-diethoxyphenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,4-oxadiazole

Systemtic Name: 5-(3,4-diethoxyphenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,4-oxadiazole Openeye Name: 5-(3,4-diethoxyphenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,4-oxadiazole CAS Name: 5-(3,4-diethoxyphenyl)-3-[3-(1-pyrrolidinylmethyl)phenyl]-1,2,4-oxadiazole IUPAC Name: 5-(3,4-diethoxyphenyl)-3-[3-(pyrrolidin-1-ylmethyl)phenyl]-1,2,4-oxadiazole Traditional Name: 5-(3,4-diethoxyphenyl)-3-[3-(pyrrolidinomethyl)phenyl]-1,2,4-oxadiazole Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC(=CC=C3)CN4CCCC4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=NO2)C3=CC(=CC=C3)CN4CCCC4)OCC

InChI

InChI=1S/C23H27N3O3/c1-3-27-20-11-10-19(15-21(20)28-4-2)23-24-22(25-29-23)18-9-7-8-17(14-18)16-26-12-5-6-13-26/h7-11,14-15H,3-6,12-13,16H2,1-2H3