[3-ethoxy-5-(3-methyl-2-oxidanylidene-butoxy)phenyl] 2-[(4-cyanophenyl)amino]ethanoate

Systemtic Name: [3-ethoxy-5-(3-methyl-2-oxidanylidene-butoxy)phenyl] 2-[(4-cyanophenyl)amino]ethanoate Openeye Name: [3-ethoxy-5-(3-methyl-2-oxo-butoxy)phenyl] 2-(4-cyanoanilino)acetate CAS Name: 2-(4-cyanoanilino)acetic acid [3-ethoxy-5-(3-methyl-2-oxobutoxy)phenyl] ester IUPAC Name: [3-ethoxy-5-(3-methyl-2-oxobutoxy)phenyl] 2-(4-cyanoanilino)acetate Traditional Name: 2-(4-cyanoanilino)acetic acid [3-ethoxy-5-(2-keto-3-methyl-butoxy)phenyl] ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)OCC(=O)C(C)C)OC(=O)CNC2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC1=CC(=CC(=C1)OCC(=O)C(C)C)OC(=O)CNC2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H24N2O5/c1-4-27-18-9-19(28-14-21(25)15(2)3)11-20(10-18)29-22(26)13-24-17-7-5-16(12-23)6-8-17/h5-11,15,24H,4,13-14H2,1-3H3