2-cyano-4-phenyl-2-(3-phenylmethoxyphenoxy)butanoic acid

Systemtic Name: 2-cyano-4-phenyl-2-(3-phenylmethoxyphenoxy)butanoic acid Openeye Name: 2-(3-benzyloxyphenoxy)-2-cyano-4-phenyl-butanoic acid CAS Name: 2-cyano-4-phenyl-2-(3-phenylmethoxyphenoxy)butanoic acid IUPAC Name: 2-cyano-4-phenyl-2-(3-phenylmethoxyphenoxy)butanoic acid Traditional Name: 2-(3-benzoxyphenoxy)-2-cyano-4-phenyl-butyric acid Formula: C24H21NO4 MolecularWeight: 387.42784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C#N)(C(=O)O)OC2=CC=CC(=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCC(C#N)(C(=O)O)OC2=CC=CC(=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C24H21NO4/c25-18-24(23(26)27,15-14-19-8-3-1-4-9-19)29-22-13-7-12-21(16-22)28-17-20-10-5-2-6-11-20/h1-13,16H,14-15,17H2,(H,26,27)