methyl 2-[4-[1-acetyloxy-2-[(4-cyanophenyl)carbonylamino]ethyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[1-acetyloxy-2-[(4-cyanophenyl)carbonylamino]ethyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[1-acetoxy-2-[(4-cyanobenzoyl)amino]ethyl]phenoxy]acetate CAS Name: 2-[4-[1-acetyloxy-2-[[(4-cyanophenyl)-oxomethyl]amino]ethyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[1-acetyloxy-2-[(4-cyanobenzoyl)amino]ethyl]phenoxy]acetate Traditional Name: 2-[4-[1-acetoxy-2-[(4-cyanobenzoyl)amino]ethyl]phenoxy]acetic acid methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O6/c1-14(24)29-19(12-23-21(26)17-5-3-15(11-22)4-6-17)16-7-9-18(10-8-16)28-13-20(25)27-2/h3-10,19H,12-13H2,1-2H3,(H,23,26)