2-[(4-cyanophenyl)amino]-2-[2-(2-ethoxy-2-oxidanylidene-ethoxy)-5-ethyl-phenyl]ethanoic acid

Systemtic Name: 2-[(4-cyanophenyl)amino]-2-[2-(2-ethoxy-2-oxidanylidene-ethoxy)-5-ethyl-phenyl]ethanoic acid Openeye Name: 2-(4-cyanoanilino)-2-[2-(2-ethoxy-2-oxo-ethoxy)-5-ethyl-phenyl]acetic acid CAS Name: 2-(4-cyanoanilino)-2-[2-(2-ethoxy-2-oxoethoxy)-5-ethylphenyl]acetic acid IUPAC Name: 2-(4-cyanoanilino)-2-[2-(2-ethoxy-2-oxoethoxy)-5-ethylphenyl]acetic acid Traditional Name: 2-(4-cyanoanilino)-2-[2-(2-ethoxy-2-keto-ethoxy)-5-ethyl-phenyl]acetic acid Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)OCC)C(C(=O)O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)OCC)C(C(=O)O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H22N2O5/c1-3-14-7-10-18(28-13-19(24)27-4-2)17(11-14)20(21(25)26)23-16-8-5-15(12-22)6-9-16/h5-11,20,23H,3-4,13H2,1-2H3,(H,25,26)