(2R)-2-[[(E)-2-benzamido-3-(4-propan-2-yloxyphenyl)prop-2-enoyl]amino]propanoic acid

Systemtic Name: (2R)-2-[[(E)-2-benzamido-3-(4-propan-2-yloxyphenyl)prop-2-enoyl]amino]propanoic acid Openeye Name: (2R)-2-[[(E)-2-benzamido-3-(4-isopropoxyphenyl)prop-2-enoyl]amino]propanoic acid CAS Name: (2R)-2-[[(E)-2-benzamido-1-oxo-3-(4-propan-2-yloxyphenyl)prop-2-enyl]amino]propanoic acid IUPAC Name: (2R)-2-[[(E)-2-benzamido-3-(4-propan-2-yloxyphenyl)prop-2-enoyl]amino]propanoic acid Traditional Name: (2R)-2-[[(E)-2-benzamido-3-(4-isopropoxyphenyl)acryloyl]amino]propionic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C=C(C(=O)NC(C)C(=O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)O)NC(=O)/C(=C\C1=CC=C(C=C1)OC(C)C)/NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H24N2O5/c1-14(2)29-18-11-9-16(10-12-18)13-19(21(26)23-15(3)22(27)28)24-20(25)17-7-5-4-6-8-17/h4-15H,1-3H3,(H,23,26)(H,24,25)(H,27,28)/b19-13+/t15-/m1/s1