2-[1-[(4-chlorophenyl)methyl]-2-methyl-5-phenylmethoxy-indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[(4-chlorophenyl)methyl]-2-methyl-5-phenylmethoxy-indol-3-yl]ethanoic acid Openeye Name: 2-[5-benzyloxy-1-[(4-chlorophenyl)methyl]-2-methyl-indol-3-yl]acetic acid CAS Name: 2-[1-[(4-chlorophenyl)methyl]-2-methyl-5-phenylmethoxy-3-indolyl]acetic acid IUPAC Name: 2-[1-[(4-chlorophenyl)methyl]-2-methyl-5-phenylmethoxyindol-3-yl]acetic acid Traditional Name: 2-[5-benzoxy-1-(4-chlorobenzyl)-2-methyl-indol-3-yl]acetic acid Formula: C25H22ClNO3 MolecularWeight: 419.90008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=C(C=C3)Cl)C=CC(=C2)OCC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=C(C=C3)Cl)C=CC(=C2)OCC4=CC=CC=C4)CC(=O)O

InChI

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