(phenylmethyl) 3-[[(E)-2-benzamido-3-(4-chlorophenyl)prop-2-enoyl]amino]propanoate

Systemtic Name: (phenylmethyl) 3-[[(E)-2-benzamido-3-(4-chlorophenyl)prop-2-enoyl]amino]propanoate Openeye Name: benzyl 3-[[(E)-2-benzamido-3-(4-chlorophenyl)prop-2-enoyl]amino]propanoate CAS Name: 3-[[(E)-2-benzamido-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[(E)-2-benzamido-3-(4-chlorophenyl)prop-2-enoyl]amino]propanoate Traditional Name: 3-[[(E)-2-benzamido-3-(4-chlorophenyl)acryloyl]amino]propionic acid benzyl ester Formula: C26H23ClN2O4 MolecularWeight: 462.92482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCNC(=O)C(=CC2=CC=C(C=C2)Cl)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCNC(=O)/C(=C\C2=CC=C(C=C2)Cl)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H23ClN2O4/c27-22-13-11-19(12-14-22)17-23(29-25(31)21-9-5-2-6-10-21)26(32)28-16-15-24(30)33-18-20-7-3-1-4-8-20/h1-14,17H,15-16,18H2,(H,28,32)(H,29,31)/b23-17+