O3-(2-ethoxyethyl) O5-ethyl 2-(aminocarbonyloxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-ethoxyethyl) O5-ethyl 2-(aminocarbonyloxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-(2-ethoxyethyl) O5-ethyl 2-(carbamoyloxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(carbamoyloxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-ethoxyethyl) ester O5-ethyl ester IUPAC Name: 3-O-(2-ethoxyethyl) 5-O-ethyl 2-(carbamoyloxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(carbamoyloxymethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-ethoxyethyl) ester O5-ethyl ester Formula: C22H27N3O9 MolecularWeight: 477.46448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O9/c1-4-31-9-10-33-21(27)19-16(12-34-22(23)28)24-13(3)17(20(26)32-5-2)18(19)14-7-6-8-15(11-14)25(29)30/h6-8,11,18,24H,4-5,9-10,12H2,1-3H3,(H2,23,28)