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

Systemtic Name: (2R)-2-[[(E)-2-benzamido-3-(4-propan-2-yloxyphenyl)prop-2-enoyl]amino]-3-phenyl-propanoic acid Openeye Name: (2R)-2-[[(E)-2-benzamido-3-(4-isopropoxyphenyl)prop-2-enoyl]amino]-3-phenyl-propanoic acid CAS Name: (2R)-2-[[(E)-2-benzamido-1-oxo-3-(4-propan-2-yloxyphenyl)prop-2-enyl]amino]-3-phenylpropanoic acid IUPAC Name: (2R)-2-[[(E)-2-benzamido-3-(4-propan-2-yloxyphenyl)prop-2-enoyl]amino]-3-phenylpropanoic acid Traditional Name: (2R)-2-[[(E)-2-benzamido-3-(4-isopropoxyphenyl)acryloyl]amino]-3-phenyl-propionic acid Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C=C(C(=O)NC(CC2=CC=CC=C2)C(=O)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)/C=C(\C(=O)N[C@H](CC2=CC=CC=C2)C(=O)O)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H28N2O5/c1-19(2)35-23-15-13-21(14-16-23)17-24(29-26(31)22-11-7-4-8-12-22)27(32)30-25(28(33)34)18-20-9-5-3-6-10-20/h3-17,19,25H,18H2,1-2H3,(H,29,31)(H,30,32)(H,33,34)/b24-17+/t25-/m1/s1