4-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]thiophene-2-carboxylic acid

Systemtic Name: 4-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]thiophene-2-carboxylic acid Openeye Name: 4-[[4-(1-methyl-1-phenyl-ethyl)phenoxy]methyl]thiophene-2-carboxylic acid CAS Name: 4-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]-2-thiophenecarboxylic acid IUPAC Name: 4-[[4-(2-phenylpropan-2-yl)phenoxy]methyl]thiophene-2-carboxylic acid Traditional Name: 4-[(4-cumylphenoxy)methyl]-2-thenoic acid Formula: C21H20O3S MolecularWeight: 352.4467

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC3=CSC(=C3)C(=O)O

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OCC3=CSC(=C3)C(=O)O

InChI

InChI=1S/C21H20O3S/c1-21(2,16-6-4-3-5-7-16)17-8-10-18(11-9-17)24-13-15-12-19(20(22)23)25-14-15/h3-12,14H,13H2,1-2H3,(H,22,23)