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

Systemtic Name: O3-[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(cyclohexylcarbamoylamino)-2-oxo-ethyl] O1-ethyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 3-O-[2-(cyclohexylcarbamoylamino)-2-oxoethyl] 1-O-ethyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(cyclohexylcarbamoylamino)-2-keto-ethyl] ester O1-ethyl ester Formula: C19H23N3O8 MolecularWeight: 421.40122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC(=O)NC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC(=O)NC2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O8/c1-2-29-17(24)12-8-13(10-15(9-12)22(27)28)18(25)30-11-16(23)21-19(26)20-14-6-4-3-5-7-14/h8-10,14H,2-7,11H2,1H3,(H2,20,21,23,26)