methyl 4-[3-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-4-methoxy-phenyl]-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate

Systemtic Name: methyl 4-[3-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-4-methoxy-phenyl]-2-methylidene-5-oxidanylidene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Openeye Name: methyl 4-[3-[(2-bromo-4-chloro-phenoxy)methyl]-4-methoxy-phenyl]-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate CAS Name: 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-2-methylene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 4-[3-[(2-bromo-4-chlorophenoxy)methyl]-4-methoxyphenyl]-2-methylidene-5-oxo-1,3,4,6,7,8-hexahydroquinoline-3-carboxylate Traditional Name: 4-[3-[(2-bromo-4-chloro-phenoxy)methyl]-4-methoxy-phenyl]-5-keto-2-methylene-1,3,4,6,7,8-hexahydroquinoline-3-carboxylic acid methyl ester Formula: C26H25BrClNO5 MolecularWeight: 546.8374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(C(=C)NC3=C2C(=O)CCC3)C(=O)OC)COC4=C(C=C(C=C4)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(C(=C)NC3=C2C(=O)CCC3)C(=O)OC)COC4=C(C=C(C=C4)Cl)Br

InChI

InChI=1S/C26H25BrClNO5/c1-14-23(26(31)33-3)24(25-19(29-14)5-4-6-20(25)30)15-7-9-21(32-2)16(11-15)13-34-22-10-8-17(28)12-18(22)27/h7-12,23-24,29H,1,4-6,13H2,2-3H3