diethyl 3,5-diethanoyl-4-(2-nitrophenyl)-1,4-dihydropyridine-2,6-dicarboxylate

Systemtic Name: diethyl 3,5-diethanoyl-4-(2-nitrophenyl)-1,4-dihydropyridine-2,6-dicarboxylate Openeye Name: diethyl 3,5-diacetyl-4-(2-nitrophenyl)-1,4-dihydropyridine-2,6-dicarboxylate CAS Name: 3,5-diacetyl-4-(2-nitrophenyl)-1,4-dihydropyridine-2,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3,5-diacetyl-4-(2-nitrophenyl)-1,4-dihydropyridine-2,6-dicarboxylate Traditional Name: 3,5-diacetyl-4-(2-nitrophenyl)-1,4-dihydropyridine-2,6-dicarboxylic acid diethyl ester Formula: C21H22N2O8 MolecularWeight: 430.40798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(C(=C(N1)C(=O)OCC)C(=O)C)C2=CC=CC=C2[N+](=O)[O-])C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C(C(=C(N1)C(=O)OCC)C(=O)C)C2=CC=CC=C2[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C21H22N2O8/c1-5-30-20(26)18-15(11(3)24)17(13-9-7-8-10-14(13)23(28)29)16(12(4)25)19(22-18)21(27)31-6-2/h7-10,17,22H,5-6H2,1-4H3