3-[4-[(2-chlorophenyl)methoxy]-3-(1-methylindol-5-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-[(2-chlorophenyl)methoxy]-3-(1-methylindol-5-yl)phenyl]propanoic acid Openeye Name: 3-[4-[(2-chlorophenyl)methoxy]-3-(1-methylindol-5-yl)phenyl]propanoic acid CAS Name: 3-[4-[(2-chlorophenyl)methoxy]-3-(1-methyl-5-indolyl)phenyl]propanoic acid IUPAC Name: 3-[4-[(2-chlorophenyl)methoxy]-3-(1-methylindol-5-yl)phenyl]propanoic acid Traditional Name: 3-[4-(2-chlorobenzyl)oxy-3-(1-methylindol-5-yl)phenyl]propionic acid Formula: C25H22ClNO3 MolecularWeight: 419.90008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)C3=C(C=CC(=C3)CCC(=O)O)OCC4=CC=CC=C4Cl

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)C3=C(C=CC(=C3)CCC(=O)O)OCC4=CC=CC=C4Cl

InChI

InChI=1S/C25H22ClNO3/c1-27-13-12-19-15-18(8-9-23(19)27)21-14-17(7-11-25(28)29)6-10-24(21)30-16-20-4-2-3-5-22(20)26/h2-6,8-10,12-15H,7,11,16H2,1H3,(H,28,29)