(phenylmethyl) 4-(3-cyanophenoxy)-3-[[4-(dimethylcarbamoyl)phenyl]carbonylamino]butanoate

Systemtic Name: (phenylmethyl) 4-(3-cyanophenoxy)-3-[[4-(dimethylcarbamoyl)phenyl]carbonylamino]butanoate Openeye Name: benzyl 4-(3-cyanophenoxy)-3-[[4-(dimethylcarbamoyl)benzoyl]amino]butanoate CAS Name: 4-(3-cyanophenoxy)-3-[[[4-[dimethylamino(oxo)methyl]phenyl]-oxomethyl]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-cyanophenoxy)-3-[[4-(dimethylcarbamoyl)benzoyl]amino]butanoate Traditional Name: 4-(3-cyanophenoxy)-3-[[4-(dimethylcarbamoyl)benzoyl]amino]butyric acid benzyl ester Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)C(=O)NC(CC(=O)OCC2=CC=CC=C2)COC3=CC=CC(=C3)C#N

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)C(=O)NC(CC(=O)OCC2=CC=CC=C2)COC3=CC=CC(=C3)C#N

InChI

InChI=1S/C28H27N3O5/c1-31(2)28(34)23-13-11-22(12-14-23)27(33)30-24(19-35-25-10-6-9-21(15-25)17-29)16-26(32)36-18-20-7-4-3-5-8-20/h3-15,24H,16,18-19H2,1-2H3,(H,30,33)