[4-chloranyl-2-(phenylmethyl)phenyl] 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: [4-chloranyl-2-(phenylmethyl)phenyl] 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (2-benzyl-4-chloro-phenyl) 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid [4-chloro-2-(phenylmethyl)phenyl] ester IUPAC Name: (2-benzyl-4-chlorophenyl) 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid (2-benzyl-4-chloro-phenyl) ester Formula: C22H17ClN2O3S MolecularWeight: 424.89998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OC(=O)CCC3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)OC(=O)CCC3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C22H17ClN2O3S/c23-18-6-7-19(17(13-18)12-15-4-2-1-3-5-15)27-21(26)9-8-20-24-22(25-28-20)16-10-11-29-14-16/h1-7,10-11,13-14H,8-9,12H2