(2S,3S)-1-butyl-3-phenyl-aziridine-2-carboxylic acid

Systemtic Name: (2S,3S)-1-butyl-3-phenyl-aziridine-2-carboxylic acid Openeye Name: (2S,3S)-1-butyl-3-phenyl-aziridine-2-carboxylic acid CAS Name: (2S,3S)-1-butyl-3-phenyl-2-aziridinecarboxylic acid IUPAC Name: (2S,3S)-1-butyl-3-phenylaziridine-2-carboxylic acid Traditional Name: (2S,3S)-1-butyl-3-phenyl-ethylenimine-2-carboxylic acid Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C1C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCN1[C@H]([C@H]1C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C13H17NO2/c1-2-3-9-14-11(12(14)13(15)16)10-7-5-4-6-8-10/h4-8,11-12H,2-3,9H2,1H3,(H,15,16)/t11-,12-,14?/m0/s1