2-[(3-nitrophenyl)carbonylamino]ethanoyl 3-(2-azanylpyridin-3-yl)propanoate

Systemtic Name: 2-[(3-nitrophenyl)carbonylamino]ethanoyl 3-(2-azanylpyridin-3-yl)propanoate Openeye Name: [2-[(3-nitrobenzoyl)amino]acetyl] 3-(2-amino-3-pyridyl)propanoate CAS Name: 3-(2-amino-3-pyridinyl)propanoic acid [2-[[(3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl] ester IUPAC Name: [2-[(3-nitrobenzoyl)amino]acetyl] 3-(2-aminopyridin-3-yl)propanoate Traditional Name: 3-(2-amino-3-pyridyl)propionic acid [2-[(3-nitrobenzoyl)amino]acetyl] ester Formula: C17H16N4O6 MolecularWeight: 372.33214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)OC(=O)CCC2=C(N=CC=C2)N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC(=O)OC(=O)CCC2=C(N=CC=C2)N

InChI

InChI=1S/C17H16N4O6/c18-16-11(4-2-8-19-16)6-7-14(22)27-15(23)10-20-17(24)12-3-1-5-13(9-12)21(25)26/h1-5,8-9H,6-7,10H2,(H2,18,19)(H,20,24)