(phenylmethyl) (2S)-1-[(E)-2-acetamido-5-phenyl-2-[(E)-3-phenylprop-2-enyl]pent-4-enoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[(E)-2-acetamido-5-phenyl-2-[(E)-3-phenylprop-2-enyl]pent-4-enoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(E)-2-acetamido-2-[(E)-cinnamyl]-5-phenyl-pent-4-enoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(E)-2-acetamido-1-oxo-5-phenyl-2-[(E)-3-phenylprop-2-enyl]pent-4-enyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(E)-2-acetamido-5-phenyl-2-[(E)-3-phenylprop-2-enyl]pent-4-enoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(E)-2-acetamido-2-[(E)-cinnamyl]-5-phenyl-pent-4-enoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C34H36N2O4 MolecularWeight: 536.66064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC=CC1=CC=CC=C1)(CC=CC2=CC=CC=C2)C(=O)N3CCCC3C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC(C(=O)N1[C@@H](CCC1)C(=O)OCC2=CC=CC=C2)(C/C=C/C3=CC=CC=C3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C34H36N2O4/c1-27(37)35-34(23-11-20-28-14-5-2-6-15-28,24-12-21-29-16-7-3-8-17-29)33(39)36-25-13-22-31(36)32(38)40-26-30-18-9-4-10-19-30/h2-12,14-21,31H,13,22-26H2,1H3,(H,35,37)/b20-11+,21-12+/t31-/m0/s1