diethyl 2-(ethyliminomethyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; N-ethylethanamine

Systemtic Name: diethyl 2-(ethyliminomethyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; N-ethylethanamine Openeye Name: diethyl 2-(ethyliminomethyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; N-ethylethanamine CAS Name: N-ethylethanamine; 2-(ethyliminomethyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(ethyliminomethyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate; N-ethylethanamine Traditional Name: diethylamine; 2-(ethyliminomethyl)-6-methyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C25H36N4O6 MolecularWeight: 488.57654

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC.CCN=CC1=C(C(C(=C(N1)C)C(=O)OCC)C2=CC=CC=C2[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCNCC.CCN=CC1=C(C(C(=C(N1)C)C(=O)OCC)C2=CC=CC=C2[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C21H25N3O6.C4H11N/c1-5-22-12-15-19(21(26)30-7-3)18(14-10-8-9-11-16(14)24(27)28)17(13(4)23-15)20(25)29-6-2;1-3-5-4-2/h8-12,18,23H,5-7H2,1-4H3;5H,3-4H2,1-2H3