dimethyl 4-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-bromo-5-ethoxy-4-methoxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(3-bromo-5-ethoxy-4-methoxy-phenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C18H20BrNO6 MolecularWeight: 426.2585

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=CNC=C2C(=O)OC)C(=O)OC)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=CNC=C2C(=O)OC)C(=O)OC)Br)OC

InChI

InChI=1S/C18H20BrNO6/c1-5-26-14-7-10(6-13(19)16(14)23-2)15-11(17(21)24-3)8-20-9-12(15)18(22)25-4/h6-9,15,20H,5H2,1-4H3