2-[4-[[(2S)-2-[(5-nitropyridin-2-yl)amino]propanoyl]amino]phenyl]ethanoate

Systemtic Name: 2-[4-[[(2S)-2-[(5-nitropyridin-2-yl)amino]propanoyl]amino]phenyl]ethanoate Openeye Name: 2-[4-[[(2S)-2-[(5-nitro-2-pyridyl)amino]propanoyl]amino]phenyl]acetate CAS Name: 2-[4-[[(2S)-2-[(5-nitro-2-pyridinyl)amino]-1-oxopropyl]amino]phenyl]acetate IUPAC Name: 2-[4-[[(2S)-2-[(5-nitropyridin-2-yl)amino]propanoyl]amino]phenyl]acetate Traditional Name: 2-[4-[[(2S)-2-[(5-nitro-2-pyridyl)amino]propanoyl]amino]phenyl]acetate Formula: C16H15N4O5- MolecularWeight: 343.3141

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)CC(=O)[O-])NC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)CC(=O)[O-])NC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O5/c1-10(18-14-7-6-13(9-17-14)20(24)25)16(23)19-12-4-2-11(3-5-12)8-15(21)22/h2-7,9-10H,8H2,1H3,(H,17,18)(H,19,23)(H,21,22)/p-1/t10-/m0/s1