[3-ethoxy-5-(3-methylbutoxy)phenyl] 2-[(4-cyanophenyl)amino]ethanoate

Systemtic Name: [3-ethoxy-5-(3-methylbutoxy)phenyl] 2-[(4-cyanophenyl)amino]ethanoate Openeye Name: (3-ethoxy-5-isopentyloxy-phenyl) 2-(4-cyanoanilino)acetate CAS Name: 2-(4-cyanoanilino)acetic acid [3-ethoxy-5-(3-methylbutoxy)phenyl] ester IUPAC Name: [3-ethoxy-5-(3-methylbutoxy)phenyl] 2-(4-cyanoanilino)acetate Traditional Name: 2-(4-cyanoanilino)acetic acid (3-ethoxy-5-isoamoxy-phenyl) ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4/c1-4-26-19-11-20(27-10-9-16(2)3)13-21(12-19)28-22(25)15-24-18-7-5-17(14-23)6-8-18/h5-8,11-13,16,24H,4,9-10,15H2,1-3H3