diethyl (4R)-2,6-dimethyl-4-(5-nitrothiophen-2-yl)-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl (4R)-2,6-dimethyl-4-(5-nitrothiophen-2-yl)-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl (4R)-2,6-dimethyl-4-(5-nitro-2-thienyl)-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4R)-2,6-dimethyl-4-(5-nitro-2-thiophenyl)-3,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl (4R)-2,6-dimethyl-4-(5-nitrothiophen-2-yl)-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4R)-2,6-dimethyl-4-(5-nitro-2-thienyl)-3,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(N=C1C)C)C(=O)OCC)C2=CC=C(S2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1[C@H](C(=C(N=C1C)C)C(=O)OCC)C2=CC=C(S2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O6S/c1-5-24-16(20)13-9(3)18-10(4)14(17(21)25-6-2)15(13)11-7-8-12(26-11)19(22)23/h7-8,13,15H,5-6H2,1-4H3/t13?,15-/m1/s1