diethyl 4-(4-bromanyl-2-ethoxycarbonyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 4-(4-bromanyl-2-ethoxycarbonyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 4-(4-bromo-2-ethoxycarbonyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(4-bromo-2-ethoxycarbonylphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-(4-bromo-2-ethoxycarbonylphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(4-bromo-2-carbethoxy-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C22H26BrNO6 MolecularWeight: 480.34894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)Br)C2C(=C(NC(=C2C(=O)OCC)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)Br)C2C(=C(NC(=C2C(=O)OCC)C)C)C(=O)OCC

InChI

InChI=1S/C22H26BrNO6/c1-6-28-20(25)16-11-14(23)9-10-15(16)19-17(21(26)29-7-2)12(4)24-13(5)18(19)22(27)30-8-3/h9-11,19,24H,6-8H2,1-5H3