(2S)-2-[(3-nitrophenyl)methylcarbamoylamino]propanoate

Systemtic Name: (2S)-2-[(3-nitrophenyl)methylcarbamoylamino]propanoate Openeye Name: (2S)-2-[(3-nitrophenyl)methylcarbamoylamino]propanoate CAS Name: (2S)-2-[[[(3-nitrophenyl)methylamino]-oxomethyl]amino]propanoate IUPAC Name: (2S)-2-[(3-nitrophenyl)methylcarbamoylamino]propanoate Traditional Name: (2S)-2-[(3-nitrobenzyl)carbamoylamino]propionate Formula: C11H12N3O5- MolecularWeight: 266.23008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])NC(=O)NCC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)[O-])NC(=O)NCC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O5/c1-7(10(15)16)13-11(17)12-6-8-3-2-4-9(5-8)14(18)19/h2-5,7H,6H2,1H3,(H,15,16)(H2,12,13,17)/p-1/t7-/m0/s1