1-acetamido-1-[(2-methylpropan-2-yl)oxycarbonyl]-5-(2-oxidanylbutyl)-5-[(E)-prop-1-enyl]pyrrolidin-1-ium-2-carboxylic acid

Systemtic Name: 1-acetamido-1-[(2-methylpropan-2-yl)oxycarbonyl]-5-(2-oxidanylbutyl)-5-[(E)-prop-1-enyl]pyrrolidin-1-ium-2-carboxylic acid Openeye Name: 1-acetamido-1-tert-butoxycarbonyl-5-(2-hydroxybutyl)-5-[(E)-prop-1-enyl]pyrrolidin-1-ium-2-carboxylic acid CAS Name: 1-acetamido-5-(2-hydroxybutyl)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-5-[(E)-prop-1-enyl]-2-pyrrolidin-1-iumcarboxylic acid IUPAC Name: 1-acetamido-5-(2-hydroxybutyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]-5-[(E)-prop-1-enyl]pyrrolidin-1-ium-2-carboxylic acid Traditional Name: 1-acetamido-1-tert-butoxycarbonyl-5-(2-hydroxybutyl)-5-[(E)-prop-1-enyl]pyrrolidin-1-ium-2-carboxylic acid Formula: C19H33N2O6+ MolecularWeight: 385.47512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1(CCC([N+]1(C(=O)OC(C)(C)C)NC(=O)C)C(=O)O)C=CC)O

Isomeric SMILES

CCC(CC1(CCC([N+]1(C(=O)OC(C)(C)C)NC(=O)C)C(=O)O)/C=C/C)O

InChI

InChI=1S/C19H32N2O6/c1-7-10-19(12-14(23)8-2)11-9-15(16(24)25)21(19,20-13(3)22)17(26)27-18(4,5)6/h7,10,14-15,23H,8-9,11-12H2,1-6H3,(H-,20,22,24,25)/p+1/b10-7+