O1-ethyl O3-[2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-[2-(methylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[2-(methylcarbamoylamino)-2-oxo-1-phenyl-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: 1-O-ethyl 3-O-[2-(methylcarbamoylamino)-2-oxo-1-phenylethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-keto-2-(methylcarbamoylamino)-1-phenyl-ethyl] ester Formula: C20H19N3O8 MolecularWeight: 429.38016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O8/c1-3-30-18(25)13-9-14(11-15(10-13)23(28)29)19(26)31-16(12-7-5-4-6-8-12)17(24)22-20(27)21-2/h4-11,16H,3H2,1-2H3,(H2,21,22,24,27)