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

Systemtic Name: O3-[2-[[3-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[3-[(cyclopropylamino)-oxomethyl]anilino]-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-[3-(cyclopropylcarbamoyl)anilino]-2-oxoethyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[3-(cyclopropylcarbamoyl)anilino]-2-keto-ethyl] ester O1-ethyl ester Formula: C22H21N3O8 MolecularWeight: 455.41744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O8/c1-2-32-21(28)14-8-15(11-18(10-14)25(30)31)22(29)33-12-19(26)23-17-5-3-4-13(9-17)20(27)24-16-6-7-16/h3-5,8-11,16H,2,6-7,12H2,1H3,(H,23,26)(H,24,27)