2-[(3-nitrophenyl)carbonylamino]ethanoyl 3-azanylpropanoate

Systemtic Name: 2-[(3-nitrophenyl)carbonylamino]ethanoyl 3-azanylpropanoate Openeye Name: [2-[(3-nitrobenzoyl)amino]acetyl] 3-aminopropanoate CAS Name: 3-aminopropanoic acid [2-[[(3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl] ester IUPAC Name: [2-[(3-nitrobenzoyl)amino]acetyl] 3-aminopropanoate Traditional Name: 3-aminopropionic acid [2-[(3-nitrobenzoyl)amino]acetyl] ester Formula: C12H13N3O6 MolecularWeight: 295.24812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)OC(=O)CCN

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)OC(=O)CCN

InChI

InChI=1S/C12H13N3O6/c13-5-4-10(16)21-11(17)7-14-12(18)8-2-1-3-9(6-8)15(19)20/h1-3,6H,4-5,7,13H2,(H,14,18)