diethyl 4-methyl-6-(methylamino)-2-(3-nitrophenyl)cyclohexa-3,6-diene-1,3-dicarboxylate

Systemtic Name: diethyl 4-methyl-6-(methylamino)-2-(3-nitrophenyl)cyclohexa-3,6-diene-1,3-dicarboxylate Openeye Name: diethyl 4-methyl-6-(methylamino)-2-(3-nitrophenyl)cyclohexa-3,6-diene-1,3-dicarboxylate CAS Name: 4-methyl-6-(methylamino)-2-(3-nitrophenyl)cyclohexa-3,6-diene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-methyl-6-(methylamino)-2-(3-nitrophenyl)cyclohexa-3,6-diene-1,3-dicarboxylate Traditional Name: 4-methyl-6-(methylamino)-2-(3-nitrophenyl)cyclohexa-3,6-diene-1,3-dicarboxylic acid diethyl ester Formula: C20H24N2O6 MolecularWeight: 388.41436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(CC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)NC)C

Isomeric SMILES

CCOC(=O)C1=C(CC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)NC)C

InChI

InChI=1S/C20H24N2O6/c1-5-27-19(23)16-12(3)10-15(21-4)18(20(24)28-6-2)17(16)13-8-7-9-14(11-13)22(25)26/h7-9,11,17,21H,5-6,10H2,1-4H3