O3-[1-[(5-chloranylpyridin-2-yl)amino]-1-oxidanylidene-propan-2-yl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[1-[(5-chloranylpyridin-2-yl)amino]-1-oxidanylidene-propan-2-yl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-[(5-chloro-2-pyridyl)amino]-1-methyl-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[1-[(5-chloro-2-pyridinyl)amino]-1-oxopropan-2-yl] ester O1-ethyl ester IUPAC Name: 3-O-[1-[(5-chloropyridin-2-yl)amino]-1-oxopropan-2-yl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[(5-chloro-2-pyridyl)amino]-2-keto-1-methyl-ethyl] ester O1-ethyl ester Formula: C18H16ClN3O7 MolecularWeight: 421.78854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C)C(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC(C)C(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C18H16ClN3O7/c1-3-28-17(24)11-6-12(8-14(7-11)22(26)27)18(25)29-10(2)16(23)21-15-5-4-13(19)9-20-15/h4-10H,3H2,1-2H3,(H,20,21,23)