5-(1-acetamido-2-methyl-2-oxidanyl-pentyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(1-acetamido-2-methyl-2-oxidanyl-pentyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Openeye Name: 5-(1-acetamido-2-hydroxy-2-methyl-pentyl)-1-tert-butoxycarbonyl-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: 5-(1-acetamido-2-hydroxy-2-methylpentyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(1-acetamido-2-hydroxy-2-methylpentyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: 5-(1-acetamido-2-hydroxy-2-methyl-pentyl)-1-tert-butoxycarbonyl-4-[(E)-prop-1-enyl]proline Formula: C21H36N2O6 MolecularWeight: 412.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C(C1C(CC(N1C(=O)OC(C)(C)C)C(=O)O)C=CC)NC(=O)C)O

Isomeric SMILES

CCCC(C)(C(C1C(CC(N1C(=O)OC(C)(C)C)C(=O)O)/C=C/C)NC(=O)C)O

InChI

InChI=1S/C21H36N2O6/c1-8-10-14-12-15(18(25)26)23(19(27)29-20(4,5)6)16(14)17(22-13(3)24)21(7,28)11-9-2/h8,10,14-17,28H,9,11-12H2,1-7H3,(H,22,24)(H,25,26)/b10-8+