(2E)-2-[(2-methyl-4-phenylmethoxy-phenyl)methylidene]heptanoic acid

Systemtic Name: (2E)-2-[(2-methyl-4-phenylmethoxy-phenyl)methylidene]heptanoic acid Openeye Name: (2E)-2-[(4-benzyloxy-2-methyl-phenyl)methylene]heptanoic acid CAS Name: (2E)-2-[(2-methyl-4-phenylmethoxyphenyl)methylidene]heptanoic acid IUPAC Name: (2E)-2-[(2-methyl-4-phenylmethoxyphenyl)methylidene]heptanoic acid Traditional Name: (E)-2-amyl-3-(4-benzoxy-2-methyl-phenyl)acrylic acid Formula: C22H26O3 MolecularWeight: 338.44004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC1=C(C=C(C=C1)OCC2=CC=CC=C2)C)C(=O)O

Isomeric SMILES

CCCCC/C(=C\C1=C(C=C(C=C1)OCC2=CC=CC=C2)C)/C(=O)O

InChI

InChI=1S/C22H26O3/c1-3-4-6-11-20(22(23)24)15-19-12-13-21(14-17(19)2)25-16-18-9-7-5-8-10-18/h5,7-10,12-15H,3-4,6,11,16H2,1-2H3,(H,23,24)/b20-15+