bis[(1S,3S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2,2,3,3-tetramethylbutanedioate

Systemtic Name: bis[(1S,3S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2,2,3,3-tetramethylbutanedioate Openeye Name: bis[(1S,2S,4S)-1,7,7-trimethylnorbornan-2-yl] 2,2,3,3-tetramethylbutanedioate CAS Name: 2,2,3,3-tetramethylbutanedioic acid bis[(1S,3S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester IUPAC Name: bis[(1S,3S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 2,2,3,3-tetramethylbutanedioate Traditional Name: 2,2,3,3-tetramethylsuccinic acid bis[(1S,2S,4S)-1,7,7-trimethylnorbornan-2-yl] ester Formula: C28H46O4 MolecularWeight: 446.66244

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(C2)OC(=O)C(C)(C)C(C)(C)C(=O)OC3CC4CCC3(C4(C)C)C)C)C

Isomeric SMILES

C[C@]12CC[C@H](C1(C)C)C[C@@H]2OC(=O)C(C)(C)C(C)(C)C(=O)O[C@H]3C[C@@H]4CC[C@]3(C4(C)C)C

InChI

InChI=1S/C28H46O4/c1-23(2)17-11-13-27(23,9)19(15-17)31-21(29)25(5,6)26(7,8)22(30)32-20-16-18-12-14-28(20,10)24(18,3)4/h17-20H,11-16H2,1-10H3/t17-,18-,19-,20-,27+,28+/m0/s1