O1-ethyl O3-[2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-ethyl O3-[2-[(4-methylcyclohexyl)amino]-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O1-ethyl O3-[2-[(4-methylcyclohexyl)amino]-2-oxo-ethyl] 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-[(4-methylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: 1-O-ethyl 3-O-[2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-ethyl ester O3-[2-keto-2-[(4-methylcyclohexyl)amino]ethyl] ester Formula: C19H24N2O7 MolecularWeight: 392.40306

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2CCC(CC2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2CCC(CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C19H24N2O7/c1-3-27-18(23)13-8-14(10-16(9-13)21(25)26)19(24)28-11-17(22)20-15-6-4-12(2)5-7-15/h8-10,12,15H,3-7,11H2,1-2H3,(H,20,22)