dimethyl 4-(5-bromanyl-4-nitro-thiophen-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(5-bromanyl-4-nitro-thiophen-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(5-bromo-4-nitro-2-thienyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(5-bromo-4-nitro-2-thiophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(5-bromo-4-nitrothiophen-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(5-bromo-4-nitro-2-thienyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C15H15BrN2O6S MolecularWeight: 431.2584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=C(S2)Br)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=C(S2)Br)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H15BrN2O6S/c1-6-10(14(19)23-3)12(11(7(2)17-6)15(20)24-4)9-5-8(18(21)22)13(16)25-9/h5,12,17H,1-4H3