3-[1-[(4-cyanophenyl)amino]-2-methoxy-2-oxidanylidene-ethyl]-2-(2-hydroxyethyloxy)-5-methoxy-benzoic acid

Systemtic Name: 3-[1-[(4-cyanophenyl)amino]-2-methoxy-2-oxidanylidene-ethyl]-2-(2-hydroxyethyloxy)-5-methoxy-benzoic acid Openeye Name: 3-[1-(4-cyanoanilino)-2-methoxy-2-oxo-ethyl]-2-(2-hydroxyethoxy)-5-methoxy-benzoic acid CAS Name: 3-[1-(4-cyanoanilino)-2-methoxy-2-oxoethyl]-2-(2-hydroxyethoxy)-5-methoxybenzoic acid IUPAC Name: 3-[1-(4-cyanoanilino)-2-methoxy-2-oxoethyl]-2-(2-hydroxyethoxy)-5-methoxybenzoic acid Traditional Name: 3-[1-(4-cyanoanilino)-2-keto-2-methoxy-ethyl]-2-(2-hydroxyethoxy)-5-methoxy-benzoic acid Formula: C20H20N2O7 MolecularWeight: 400.382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O7/c1-27-14-9-15(18(29-8-7-23)16(10-14)19(24)25)17(20(26)28-2)22-13-5-3-12(11-21)4-6-13/h3-6,9-10,17,22-23H,7-8H2,1-2H3,(H,24,25)