5-[1-acetamido-2-(hydroxymethyl)-2-oxidanyl-pentyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 5-[1-acetamido-2-(hydroxymethyl)-2-oxidanyl-pentyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Openeye Name: 5-[1-acetamido-2-hydroxy-2-(hydroxymethyl)pentyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: 5-[1-acetamido-2-hydroxy-2-(hydroxymethyl)pentyl]-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 5-[1-acetamido-2-hydroxy-2-(hydroxymethyl)pentyl]-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: 5-(1-acetamido-2-hydroxy-2-methylol-pentyl)-4-[(E)-prop-1-enyl]proline Formula: C16H28N2O5 MolecularWeight: 328.40392

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CO)(C(C1C(CC(N1)C(=O)O)C=CC)NC(=O)C)O

Isomeric SMILES

CCCC(CO)(C(C1C(CC(N1)C(=O)O)/C=C/C)NC(=O)C)O

InChI

InChI=1S/C16H28N2O5/c1-4-6-11-8-12(15(21)22)18-13(11)14(17-10(3)20)16(23,9-19)7-5-2/h4,6,11-14,18-19,23H,5,7-9H2,1-3H3,(H,17,20)(H,21,22)/b6-4+