5-(1-acetamido-3-methylidene-2-oxidanyl-pentyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(1-acetamido-3-methylidene-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-3-methylene-pentyl)-1-tert-butoxycarbonyl-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: 5-(1-acetamido-2-hydroxy-3-methylenepentyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-(1-acetamido-2-hydroxy-3-methylidenepentyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: 5-(1-acetamido-3-ethyl-2-hydroxy-but-3-enyl)-1-tert-butoxycarbonyl-4-[(E)-prop-1-enyl]proline Formula: C21H34N2O6 MolecularWeight: 410.50446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2O6/c1-8-10-14-11-15(19(26)27)23(20(28)29-21(5,6)7)17(14)16(22-13(4)24)18(25)12(3)9-2/h8,10,14-18,25H,3,9,11H2,1-2,4-7H3,(H,22,24)(H,26,27)/b10-8+