2-[(4-cyanophenyl)amino]-2-[4,5-dimethoxy-2-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]ethanoic acid

Systemtic Name: 2-[(4-cyanophenyl)amino]-2-[4,5-dimethoxy-2-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]ethanoic acid Openeye Name: 2-(4-cyanoanilino)-2-[4,5-dimethoxy-2-(2-methoxy-2-oxo-ethoxy)phenyl]acetic acid CAS Name: 2-(4-cyanoanilino)-2-[4,5-dimethoxy-2-(2-methoxy-2-oxoethoxy)phenyl]acetic acid IUPAC Name: 2-(4-cyanoanilino)-2-[4,5-dimethoxy-2-(2-methoxy-2-oxoethoxy)phenyl]acetic acid Traditional Name: 2-(4-cyanoanilino)-2-[2-(2-keto-2-methoxy-ethoxy)-4,5-dimethoxy-phenyl]acetic acid Formula: C20H20N2O7 MolecularWeight: 400.382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)OCC(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)OCC(=O)OC)OC

InChI

InChI=1S/C20H20N2O7/c1-26-16-8-14(15(9-17(16)27-2)29-11-18(23)28-3)19(20(24)25)22-13-6-4-12(10-21)5-7-13/h4-9,19,22H,11H2,1-3H3,(H,24,25)