3-[4-(furan-2-ylmethoxy)-3-(1H-indol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-(furan-2-ylmethoxy)-3-(1H-indol-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-(2-furylmethoxy)-3-(1H-indol-5-yl)phenyl]propanoic acid CAS Name: 3-[4-(2-furanylmethoxy)-3-(1H-indol-5-yl)phenyl]propanoic acid IUPAC Name: 3-[4-(furan-2-ylmethoxy)-3-(1H-indol-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-(2-furfuryloxy)-3-(1H-indol-5-yl)phenyl]propionic acid Formula: C22H19NO4 MolecularWeight: 361.39056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)COC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)NC=C4

Isomeric SMILES

C1=COC(=C1)COC2=C(C=C(C=C2)CCC(=O)O)C3=CC4=C(C=C3)NC=C4

InChI

InChI=1S/C22H19NO4/c24-22(25)8-4-15-3-7-21(27-14-18-2-1-11-26-18)19(12-15)16-5-6-20-17(13-16)9-10-23-20/h1-3,5-7,9-13,23H,4,8,14H2,(H,24,25)