(1S,2S)-1-azaniumyl-2-(phenylmethoxycarbonylaminomethyl)cyclopropane-1-carboxylate

Systemtic Name: (1S,2S)-1-azaniumyl-2-(phenylmethoxycarbonylaminomethyl)cyclopropane-1-carboxylate Openeye Name: (1S,2S)-1-azaniumyl-2-(benzyloxycarbonylaminomethyl)cyclopropanecarboxylate CAS Name: (1S,2S)-1-ammonio-2-(phenylmethoxycarbonylaminomethyl)-1-cyclopropanecarboxylate IUPAC Name: (1S,2S)-1-azaniumyl-2-(phenylmethoxycarbonylaminomethyl)cyclopropane-1-carboxylate Traditional Name: (1S,2S)-1-ammonio-2-(benzyloxycarbonylaminomethyl)cyclopropanecarboxylate Formula: C13H16N2O4 MolecularWeight: 264.27714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C1(C(=O)[O-])[NH3+])CNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1[C@H]([C@@]1(C(=O)[O-])[NH3+])CNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H16N2O4/c14-13(11(16)17)6-10(13)7-15-12(18)19-8-9-4-2-1-3-5-9/h1-5,10H,6-8,14H2,(H,15,18)(H,16,17)/t10-,13-/m0/s1