triethyl 2-(2-chloranyl-3-methyl-5-nitro-phenyl)ethane-1,1,1-tricarboxylate

Systemtic Name: triethyl 2-(2-chloranyl-3-methyl-5-nitro-phenyl)ethane-1,1,1-tricarboxylate Openeye Name: triethyl 2-(2-chloro-3-methyl-5-nitro-phenyl)ethane-1,1,1-tricarboxylate CAS Name: 2-(2-chloro-3-methyl-5-nitrophenyl)ethane-1,1,1-tricarboxylic acid triethyl ester IUPAC Name: triethyl 2-(2-chloro-3-methyl-5-nitrophenyl)ethane-1,1,1-tricarboxylate Traditional Name: 2-(2-chloro-3-methyl-5-nitro-phenyl)ethane-1,1,1-tricarboxylic acid triethyl ester Formula: C18H22ClNO8 MolecularWeight: 415.82218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C(=CC(=C1)[N+](=O)[O-])C)Cl)(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=C(C(=CC(=C1)[N+](=O)[O-])C)Cl)(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C18H22ClNO8/c1-5-26-15(21)18(16(22)27-6-2,17(23)28-7-3)10-12-9-13(20(24)25)8-11(4)14(12)19/h8-9H,5-7,10H2,1-4H3