2-[(3E)-3-[(4-chlorophenyl)methylidene]-2-methyl-6-(quinolin-2-ylmethoxy)inden-1-yl]ethanoic acid

Systemtic Name: 2-[(3E)-3-[(4-chlorophenyl)methylidene]-2-methyl-6-(quinolin-2-ylmethoxy)inden-1-yl]ethanoic acid Openeye Name: 2-[(3E)-3-[(4-chlorophenyl)methylene]-2-methyl-6-(2-quinolylmethoxy)inden-1-yl]acetic acid CAS Name: 2-[(3E)-3-[(4-chlorophenyl)methylidene]-2-methyl-6-(2-quinolinylmethoxy)-1-indenyl]acetic acid IUPAC Name: 2-[(3E)-3-[(4-chlorophenyl)methylidene]-2-methyl-6-(quinolin-2-ylmethoxy)inden-1-yl]acetic acid Traditional Name: 2-[(3E)-3-(4-chlorobenzylidene)-2-methyl-6-(2-quinolylmethoxy)inden-1-yl]acetic acid Formula: C29H22ClNO3 MolecularWeight: 467.94288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC=C(C=C3)Cl)C=CC(=C2)OCC4=NC5=CC=CC=C5C=C4)CC(=O)O

Isomeric SMILES

CC\1=C(C2=C(/C1=C/C3=CC=C(C=C3)Cl)C=CC(=C2)OCC4=NC5=CC=CC=C5C=C4)CC(=O)O

InChI

InChI=1S/C29H22ClNO3/c1-18-25(14-19-6-9-21(30)10-7-19)24-13-12-23(15-27(24)26(18)16-29(32)33)34-17-22-11-8-20-4-2-3-5-28(20)31-22/h2-15H,16-17H2,1H3,(H,32,33)/b25-14+