[2-cyano-5-(2-methylpropanoyloxy)phenyl] 4-(2-methylpropanoylamino)benzoate

Systemtic Name: [2-cyano-5-(2-methylpropanoyloxy)phenyl] 4-(2-methylpropanoylamino)benzoate Openeye Name: [2-cyano-5-(2-methylpropanoyloxy)phenyl] 4-(2-methylpropanoylamino)benzoate CAS Name: 4-[(2-methyl-1-oxopropyl)amino]benzoic acid [2-cyano-5-(2-methyl-1-oxopropoxy)phenyl] ester IUPAC Name: [2-cyano-5-(2-methylpropanoyloxy)phenyl] 4-(2-methylpropanoylamino)benzoate Traditional Name: 4-(isobutyrylamino)benzoic acid (2-cyano-5-isobutyryloxy-phenyl) ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)OC(=O)C(C)C)C#N

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)OC(=O)C(C)C)C#N

InChI

InChI=1S/C22H22N2O5/c1-13(2)20(25)24-17-8-5-15(6-9-17)22(27)29-19-11-18(10-7-16(19)12-23)28-21(26)14(3)4/h5-11,13-14H,1-4H3,(H,24,25)