3-[2-(5-chloranyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]-5-methyl-benzoic acid

Systemtic Name: 3-[2-(5-chloranyl-2-phenylmethoxy-phenyl)cyclopenten-1-yl]-5-methyl-benzoic acid Openeye Name: 3-[2-(2-benzyloxy-5-chloro-phenyl)cyclopenten-1-yl]-5-methyl-benzoic acid CAS Name: 3-[2-(5-chloro-2-phenylmethoxyphenyl)-1-cyclopentenyl]-5-methylbenzoic acid IUPAC Name: 3-[2-(5-chloro-2-phenylmethoxyphenyl)cyclopenten-1-yl]-5-methylbenzoic acid Traditional Name: 3-[2-(2-benzoxy-5-chloro-phenyl)cyclopenten-1-yl]-5-methyl-benzoic acid Formula: C26H23ClO3 MolecularWeight: 418.91202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)O)C2=C(CCC2)C3=C(C=CC(=C3)Cl)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)O)C2=C(CCC2)C3=C(C=CC(=C3)Cl)OCC4=CC=CC=C4

InChI

InChI=1S/C26H23ClO3/c1-17-12-19(14-20(13-17)26(28)29)22-8-5-9-23(22)24-15-21(27)10-11-25(24)30-16-18-6-3-2-4-7-18/h2-4,6-7,10-15H,5,8-9,16H2,1H3,(H,28,29)