N-ethylethanamide; 1-(2-oxidanylbutyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid

Systemtic Name: N-ethylethanamide; 1-(2-oxidanylbutyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Openeye Name: N-ethylacetamide; 1-(2-hydroxybutyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid CAS Name: N-ethylacetamide; 1-(2-hydroxybutyl)-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylic acid IUPAC Name: N-ethylacetamide; 1-(2-hydroxybutyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylic acid Traditional Name: N-ethylacetamide; 1-(2-hydroxybutyl)-4-[(E)-prop-1-enyl]proline Formula: C16H30N2O4 MolecularWeight: 314.4204

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1CC(CC1C(=O)O)C=CC)O.CCNC(=O)C

Isomeric SMILES

CCC(CN1CC(CC1C(=O)O)/C=C/C)O.CCNC(=O)C

InChI

InChI=1S/C12H21NO3.C4H9NO/c1-3-5-9-6-11(12(15)16)13(7-9)8-10(14)4-2;1-3-5-4(2)6/h3,5,9-11,14H,4,6-8H2,1-2H3,(H,15,16);3H2,1-2H3,(H,5,6)/b5-3+;