2-[[(E)-2-methyl-3-phenyl-prop-2-enoyl]-(phenylmethyl)amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(E)-2-methyl-3-phenyl-prop-2-enoyl]-(phenylmethyl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[benzyl-[(E)-2-methyl-3-phenyl-prop-2-enoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(E)-2-methyl-1-oxo-3-phenylprop-2-enyl]-(phenylmethyl)amino]-3-phenylpropanoic acid IUPAC Name: 2-[benzyl-[(E)-2-methyl-3-phenylprop-2-enoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[benzyl-[(E)-2-methyl-3-phenyl-acryloyl]amino]-3-phenyl-propionic acid Formula: C26H25NO3 MolecularWeight: 399.4816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C(=O)N(CC2=CC=CC=C2)C(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C(=O)N(CC2=CC=CC=C2)C(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H25NO3/c1-20(17-21-11-5-2-6-12-21)25(28)27(19-23-15-9-4-10-16-23)24(26(29)30)18-22-13-7-3-8-14-22/h2-17,24H,18-19H2,1H3,(H,29,30)/b20-17+