1,3-benzodioxol-5-yl (2S)-2-[(3-nitrophenyl)carbonylamino]propanoate

Systemtic Name: 1,3-benzodioxol-5-yl (2S)-2-[(3-nitrophenyl)carbonylamino]propanoate Openeye Name: 1,3-benzodioxol-5-yl (2S)-2-[(3-nitrobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(3-nitrophenyl)-oxomethyl]amino]propanoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (2S)-2-[(3-nitrobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(3-nitrobenzoyl)amino]propionic acid 1,3-benzodioxol-5-yl ester Formula: C17H14N2O7 MolecularWeight: 358.30226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)OC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O7/c1-10(18-16(20)11-3-2-4-12(7-11)19(22)23)17(21)26-13-5-6-14-15(8-13)25-9-24-14/h2-8,10H,9H2,1H3,(H,18,20)/t10-/m0/s1