3-[3-methoxy-2-[3-[1-(phenylmethyl)indol-7-yl]phenyl]phenyl]propanoic acid

Systemtic Name: 3-[3-methoxy-2-[3-[1-(phenylmethyl)indol-7-yl]phenyl]phenyl]propanoic acid Openeye Name: 3-[2-[3-(1-benzylindol-7-yl)phenyl]-3-methoxy-phenyl]propanoic acid CAS Name: 3-[3-methoxy-2-[3-[1-(phenylmethyl)-7-indolyl]phenyl]phenyl]propanoic acid IUPAC Name: 3-[2-[3-(1-benzylindol-7-yl)phenyl]-3-methoxyphenyl]propanoic acid Traditional Name: 3-[2-[3-(1-benzylindol-7-yl)phenyl]-3-methoxy-phenyl]propionic acid Formula: C31H27NO3 MolecularWeight: 461.55098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C2=CC=CC(=C2)C3=CC=CC4=C3N(C=C4)CC5=CC=CC=C5)CCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1C2=CC=CC(=C2)C3=CC=CC4=C3N(C=C4)CC5=CC=CC=C5)CCC(=O)O

InChI

InChI=1S/C31H27NO3/c1-35-28-15-7-10-23(16-17-29(33)34)30(28)26-13-5-12-25(20-26)27-14-6-11-24-18-19-32(31(24)27)21-22-8-3-2-4-9-22/h2-15,18-20H,16-17,21H2,1H3,(H,33,34)