ethyl (1R,2S,3R,4S,6R)-2,6-bis(3-bromophenyl)-1-cyano-4-naphthalen-2-yl-3-naphthalen-2-ylcarbonyl-4-oxidanyl-cyclohexane-1-carboxylate

Systemtic Name: ethyl (1R,2S,3R,4S,6R)-2,6-bis(3-bromophenyl)-1-cyano-4-naphthalen-2-yl-3-naphthalen-2-ylcarbonyl-4-oxidanyl-cyclohexane-1-carboxylate Openeye Name: ethyl (1R,2S,3R,4S,6R)-2,6-bis(3-bromophenyl)-1-cyano-4-hydroxy-3-(naphthalene-2-carbonyl)-4-(2-naphthyl)cyclohexanecarboxylate CAS Name: (1R,2S,3R,4S,6R)-2,6-bis(3-bromophenyl)-1-cyano-4-hydroxy-4-(2-naphthalenyl)-3-[2-naphthalenyl(oxo)methyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,2S,3R,4S,6R)-2,6-bis(3-bromophenyl)-1-cyano-4-hydroxy-3-(naphthalene-2-carbonyl)-4-naphthalen-2-ylcyclohexane-1-carboxylate Traditional Name: (1R,2S,3R,4S,6R)-2,6-bis(3-bromophenyl)-1-cyano-4-hydroxy-3-(2-naphthoyl)-4-(2-naphthyl)cyclohexanecarboxylic acid ethyl ester Formula: C43H33Br2NO4 MolecularWeight: 787.53442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CC(C(C1C2=CC(=CC=C2)Br)C(=O)C3=CC4=CC=CC=C4C=C3)(C5=CC6=CC=CC=C6C=C5)O)C7=CC(=CC=C7)Br)C#N

Isomeric SMILES

CCOC(=O)[C@@]1([C@H](C[C@]([C@@H]([C@H]1C2=CC(=CC=C2)Br)C(=O)C3=CC4=CC=CC=C4C=C3)(C5=CC6=CC=CC=C6C=C5)O)C7=CC(=CC=C7)Br)C#N

InChI

InChI=1S/C43H33Br2NO4/c1-2-50-41(48)42(26-46)37(31-13-7-15-35(44)23-31)25-43(49,34-20-19-28-10-4-6-12-30(28)22-34)39(38(42)32-14-8-16-36(45)24-32)40(47)33-18-17-27-9-3-5-11-29(27)21-33/h3-24,37-39,49H,2,25H2,1H3/t37-,38-,39+,42-,43-/m1/s1