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

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

Systemtic Name:3-[2-(5-cyano-2-phenylmethoxy-phenyl)cyclopenten-1-yl]benzoic acid
Openeye Name:3-[2-(2-benzyloxy-5-cyano-phenyl)cyclopenten-1-yl]benzoic acid
CAS Name:3-[2-(5-cyano-2-phenylmethoxyphenyl)-1-cyclopentenyl]benzoic acid
IUPAC Name:3-[2-(5-cyano-2-phenylmethoxyphenyl)cyclopenten-1-yl]benzoic acid
Traditional Name:3-[2-(2-benzoxy-5-cyano-phenyl)cyclopenten-1-yl]benzoic acid
Formula: C26H21NO3
MolecularWeight: 395.44984
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)C2=C(C=CC(=C2)C#N)OCC3=CC=CC=C3)C4=CC(=CC=C4)C(=O)O


Isomeric SMILES

C1CC(=C(C1)C2=C(C=CC(=C2)C#N)OCC3=CC=CC=C3)C4=CC(=CC=C4)C(=O)O


InChI

InChI=1S/C26H21NO3/c27-16-19-12-13-25(30-17-18-6-2-1-3-7-18)24(14-19)23-11-5-10-22(23)20-8-4-9-21(15-20)26(28)29/h1-4,6-9,12-15H,5,10-11,17H2,(H,28,29)


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