[(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] (2R)-2-benzamido-2-ethenyl-6-iodanyl-hexanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] (2R)-2-benzamido-2-ethenyl-6-iodanyl-hexanoate Openeye Name: [(1R,2S,5R)-5-methyl-2-[1-methyl-1-(2-naphthyl)ethyl]cyclohexyl] (2R)-2-benzamido-6-iodo-2-vinyl-hexanoate CAS Name: (2R)-2-benzamido-2-ethenyl-6-iodohexanoic acid [(1R,2S,5R)-5-methyl-2-[2-(2-naphthalenyl)propan-2-yl]cyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-(2-naphthalen-2-ylpropan-2-yl)cyclohexyl] (2R)-2-benzamido-2-ethenyl-6-iodohexanoate Traditional Name: (2R)-2-benzamido-2-(4-iodobutyl)but-3-enoic acid [(1R,2S,5R)-5-methyl-2-[1-methyl-1-(2-naphthyl)ethyl]cyclohexyl] ester Formula: C35H42INO3 MolecularWeight: 651.61735

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C(CCCCI)(C=C)NC(=O)C2=CC=CC=C2)C(C)(C)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)[C@@](CCCCI)(C=C)NC(=O)C2=CC=CC=C2)C(C)(C)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C35H42INO3/c1-5-35(21-11-12-22-36,37-32(38)27-14-7-6-8-15-27)33(39)40-31-23-25(2)17-20-30(31)34(3,4)29-19-18-26-13-9-10-16-28(26)24-29/h5-10,13-16,18-19,24-25,30-31H,1,11-12,17,20-23H2,2-4H3,(H,37,38)/t25-,30-,31-,35+/m1/s1