ethyl 3-[2-[(3-nitrophenyl)carbonylamino]ethanoylamino]propanoate

Systemtic Name: ethyl 3-[2-[(3-nitrophenyl)carbonylamino]ethanoylamino]propanoate Openeye Name: ethyl 3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propanoate CAS Name: 3-[[2-[[(3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propanoate Traditional Name: 3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propionic acid ethyl ester Formula: C14H17N3O6 MolecularWeight: 323.30128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCNC(=O)CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O6/c1-2-23-13(19)6-7-15-12(18)9-16-14(20)10-4-3-5-11(8-10)17(21)22/h3-5,8H,2,6-7,9H2,1H3,(H,15,18)(H,16,20)