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

Systemtic Name: O3-[2-(cyclopentylamino)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(cyclopentylamino)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(cyclopentylamino)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(cyclopentylamino)-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(cyclopentylamino)-2-keto-ethyl] ester O1-methyl ester Formula: C16H18N2O7 MolecularWeight: 350.32332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2CCCC2

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2CCCC2

InChI

InChI=1S/C16H18N2O7/c1-24-15(20)10-6-11(8-13(7-10)18(22)23)16(21)25-9-14(19)17-12-4-2-3-5-12/h6-8,12H,2-5,9H2,1H3,(H,17,19)