2-[(3Z)-6-chloranyl-2-methyl-3-[(4-phenylmethoxyphenyl)methylidene]inden-1-yl]ethanoic acid

Systemtic Name: 2-[(3Z)-6-chloranyl-2-methyl-3-[(4-phenylmethoxyphenyl)methylidene]inden-1-yl]ethanoic acid Openeye Name: 2-[(3Z)-3-[(4-benzyloxyphenyl)methylene]-6-chloro-2-methyl-inden-1-yl]acetic acid CAS Name: 2-[(3Z)-6-chloro-2-methyl-3-[(4-phenylmethoxyphenyl)methylidene]-1-indenyl]acetic acid IUPAC Name: 2-[(3Z)-6-chloro-2-methyl-3-[(4-phenylmethoxyphenyl)methylidene]inden-1-yl]acetic acid Traditional Name: 2-[(3Z)-3-(4-benzoxybenzylidene)-6-chloro-2-methyl-inden-1-yl]acetic acid Formula: C26H21ClO3 MolecularWeight: 416.89614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H21ClO3/c1-17-23(22-12-9-20(27)14-25(22)24(17)15-26(28)29)13-18-7-10-21(11-8-18)30-16-19-5-3-2-4-6-19/h2-14H,15-16H2,1H3,(H,28,29)/b23-13-