(E)-4-naphthalen-2-yl-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoic acid

Systemtic Name: (E)-4-naphthalen-2-yl-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoic acid Openeye Name: (E)-4-(2-naphthyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]but-3-enoic acid CAS Name: (E)-4-(2-naphthalenyl)-3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]-3-butenoic acid IUPAC Name: (E)-4-naphthalen-2-yl-3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)but-3-enoic acid Traditional Name: (E)-4-(2-naphthyl)-3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]but-3-enoic acid Formula: C20H14N2O3S MolecularWeight: 362.40176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C=C(CC(=O)O)C3=NC(=NO3)C4=CSC=C4

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)/C=C(\CC(=O)O)/C3=NC(=NO3)C4=CSC=C4

InChI

InChI=1S/C20H14N2O3S/c23-18(24)11-17(20-21-19(22-25-20)16-7-8-26-12-16)10-13-5-6-14-3-1-2-4-15(14)9-13/h1-10,12H,11H2,(H,23,24)/b17-10+