2-[(4-cyano-3-phenylmethoxy-phenyl)amino]-2-(3,4-diethoxyphenyl)ethanoic acid

Systemtic Name: 2-[(4-cyano-3-phenylmethoxy-phenyl)amino]-2-(3,4-diethoxyphenyl)ethanoic acid Openeye Name: 2-(3-benzyloxy-4-cyano-anilino)-2-(3,4-diethoxyphenyl)acetic acid CAS Name: 2-(4-cyano-3-phenylmethoxyanilino)-2-(3,4-diethoxyphenyl)acetic acid IUPAC Name: 2-(4-cyano-3-phenylmethoxyanilino)-2-(3,4-diethoxyphenyl)acetic acid Traditional Name: 2-(3-benzoxy-4-cyano-anilino)-2-(3,4-diethoxyphenyl)acetic acid Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C(=O)O)NC2=CC(=C(C=C2)C#N)OCC3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C(=O)O)NC2=CC(=C(C=C2)C#N)OCC3=CC=CC=C3)OCC

InChI

InChI=1S/C26H26N2O5/c1-3-31-22-13-11-19(14-24(22)32-4-2)25(26(29)30)28-21-12-10-20(16-27)23(15-21)33-17-18-8-6-5-7-9-18/h5-15,25,28H,3-4,17H2,1-2H3,(H,29,30)