O7-tert-butyl O2-methyl (5Z)-5-(bromanylmethylidene)-1,4-dihydroazepine-2,7-dicarboxylate

Systemtic Name: O7-tert-butyl O2-methyl (5Z)-5-(bromanylmethylidene)-1,4-dihydroazepine-2,7-dicarboxylate Openeye Name: O7-tert-butyl O2-methyl (5Z)-5-(bromomethylene)-1,4-dihydroazepine-2,7-dicarboxylate CAS Name: (5Z)-5-(bromomethylidene)-1,4-dihydroazepine-2,7-dicarboxylic acid O7-tert-butyl ester O2-methyl ester IUPAC Name: 7-O-tert-butyl 2-O-methyl (5Z)-5-(bromomethylidene)-1,4-dihydroazepine-2,7-dicarboxylate Traditional Name: (5Z)-5-(bromomethylene)-1,4-dihydroazepine-2,7-dicarboxylic acid O7-tert-butyl ester O2-methyl ester Formula: C14H18BrNO4 MolecularWeight: 344.20102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=CBr)CC=C(N1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=C/C(=C\Br)/CC=C(N1)C(=O)OC

InChI

InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(18)11-7-9(8-15)5-6-10(16-11)12(17)19-4/h6-8,16H,5H2,1-4H3/b9-8-