(2S,3S)-3-(1,3-benzodioxol-5-yl)aziridine-2-carboxylic acid

Systemtic Name: (2S,3S)-3-(1,3-benzodioxol-5-yl)aziridine-2-carboxylic acid Openeye Name: (2S,3S)-3-(1,3-benzodioxol-5-yl)aziridine-2-carboxylic acid CAS Name: (2S,3S)-3-(1,3-benzodioxol-5-yl)-2-aziridinecarboxylic acid IUPAC Name: (2S,3S)-3-(1,3-benzodioxol-5-yl)aziridine-2-carboxylic acid Traditional Name: (2S,3S)-3-(1,3-benzodioxol-5-yl)ethylenimine-2-carboxylic acid Formula: C10H9NO4 MolecularWeight: 207.18276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3C(N3)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@H]3[C@H](N3)C(=O)O

InChI

InChI=1S/C10H9NO4/c12-10(13)9-8(11-9)5-1-2-6-7(3-5)15-4-14-6/h1-3,8-9,11H,4H2,(H,12,13)/t8-,9-/m0/s1