(phenylmethyl) 3-[[3-[2-(4-cyanophenyl)ethanoylamino]phenyl]carbonylamino]propanoate

Systemtic Name: (phenylmethyl) 3-[[3-[2-(4-cyanophenyl)ethanoylamino]phenyl]carbonylamino]propanoate Openeye Name: benzyl 3-[[3-[[2-(4-cyanophenyl)acetyl]amino]benzoyl]amino]propanoate CAS Name: 3-[[[3-[[2-(4-cyanophenyl)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[3-[[2-(4-cyanophenyl)acetyl]amino]benzoyl]amino]propanoate Traditional Name: 3-[[3-[[2-(4-cyanophenyl)acetyl]amino]benzoyl]amino]propionic acid benzyl ester Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCNC(=O)C2=CC(=CC=C2)NC(=O)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCNC(=O)C2=CC(=CC=C2)NC(=O)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C26H23N3O4/c27-17-20-11-9-19(10-12-20)15-24(30)29-23-8-4-7-22(16-23)26(32)28-14-13-25(31)33-18-21-5-2-1-3-6-21/h1-12,16H,13-15,18H2,(H,28,32)(H,29,30)