methyl (2S)-2-[(2S)-2-(phenylcarbamoyl)aziridin-1-yl]propanoate

Systemtic Name: methyl (2S)-2-[(2S)-2-(phenylcarbamoyl)aziridin-1-yl]propanoate Openeye Name: methyl (2S)-2-[(2S)-2-(phenylcarbamoyl)aziridin-1-yl]propanoate CAS Name: (2S)-2-[(2S)-2-[anilino(oxo)methyl]-1-aziridinyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2S)-2-(phenylcarbamoyl)aziridin-1-yl]propanoate Traditional Name: (2S)-2-[(2S)-2-(phenylcarbamoyl)ethylenimin-1-yl]propionic acid methyl ester Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N1CC1C(=O)NC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)OC)N1C[C@H]1C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C13H16N2O3/c1-9(13(17)18-2)15-8-11(15)12(16)14-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,16)/t9-,11-,15?/m0/s1