dimethyl 2,6-dimethyl-4-(5-nitrothiophen-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2,6-dimethyl-4-(5-nitrothiophen-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2,6-dimethyl-4-(5-nitro-3-thienyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(5-nitro-3-thiophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,6-dimethyl-4-(5-nitrothiophen-3-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(5-nitro-3-thienyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C15H16N2O6S MolecularWeight: 352.36234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CSC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CSC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H16N2O6S/c1-7-11(14(18)22-3)13(9-5-10(17(20)21)24-6-9)12(8(2)16-7)15(19)23-4/h5-6,13,16H,1-4H3