(phenylmethyl) (2S)-1-[2-acetamido-4-methyl-2-(2-methylprop-2-enyl)pent-4-enoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[2-acetamido-4-methyl-2-(2-methylprop-2-enyl)pent-4-enoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[2-acetamido-4-methyl-2-(2-methylallyl)pent-4-enoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[2-acetamido-4-methyl-2-(2-methylprop-2-enyl)-1-oxopent-4-enyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[2-acetamido-4-methyl-2-(2-methylprop-2-enyl)pent-4-enoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-acetamido-4-methyl-2-(2-methylallyl)pent-4-enoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC(CC(=C)C)(C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC(=C)CC(CC(=C)C)(C(=O)N1CCC[C@H]1C(=O)OCC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C24H32N2O4/c1-17(2)14-24(15-18(3)4,25-19(5)27)23(29)26-13-9-12-21(26)22(28)30-16-20-10-7-6-8-11-20/h6-8,10-11,21H,1,3,9,12-16H2,2,4-5H3,(H,25,27)/t21-/m0/s1