1-(3-acetamido-2-ethyl-3-oxidanyl-butyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-acetamido-2-ethyl-3-oxidanyl-butyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetamido-2-ethyl-3-hydroxy-butyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: 1-(3-acetamido-2-ethyl-3-hydroxybutyl)-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetamido-2-ethyl-3-hydroxybutyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(3-acetamido-2-ethyl-3-hydroxy-butyl)-4-[(E)-prop-1-enyl]proline Formula: C16H28N2O4 MolecularWeight: 312.40452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1CC(CC1C(=O)O)C=CC)C(C)(NC(=O)C)O

Isomeric SMILES

CCC(CN1CC(CC1C(=O)O)/C=C/C)C(C)(NC(=O)C)O

InChI

InChI=1S/C16H28N2O4/c1-5-7-12-8-14(15(20)21)18(9-12)10-13(6-2)16(4,22)17-11(3)19/h5,7,12-14,22H,6,8-10H2,1-4H3,(H,17,19)(H,20,21)/b7-5+