azanium 5-(1-acetamido-2-oxidanyl-butyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylate

Systemtic Name: azanium 5-(1-acetamido-2-oxidanyl-butyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylate Openeye Name: ammonium 5-(1-acetamido-2-hydroxy-butyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylate CAS Name: ammonium 5-(1-acetamido-2-hydroxybutyl)-4-[(E)-prop-1-enyl]-2-pyrrolidinecarboxylate IUPAC Name: azanium 5-(1-acetamido-2-hydroxybutyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylate Traditional Name: ammonium 5-(1-acetamido-2-hydroxy-butyl)-4-[(E)-prop-1-enyl]pyrrolidine-2-carboxylate Formula: C14H27N3O4 MolecularWeight: 301.38188

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1C(CC(N1)C(=O)[O-])C=CC)NC(=O)C)O.[NH4+]

Isomeric SMILES

CCC(C(C1C(CC(N1)C(=O)[O-])/C=C/C)NC(=O)C)O.[NH4+]

InChI

InChI=1S/C14H24N2O4.H3N/c1-4-6-9-7-10(14(19)20)16-12(9)13(11(18)5-2)15-8(3)17;/h4,6,9-13,16,18H,5,7H2,1-3H3,(H,15,17)(H,19,20);1H3/b6-4+;