[(1'S,3'R,4'R)-4',7',7'-trimethylspiro[1,3-dihydroindene-2,2'-bicyclo[2.2.1]heptane]-3'-yl] 3-methyl-2-(phenylmethyl)butanoate

Systemtic Name: [(1'S,3'R,4'R)-4',7',7'-trimethylspiro[1,3-dihydroindene-2,2'-bicyclo[2.2.1]heptane]-3'-yl] 3-methyl-2-(phenylmethyl)butanoate Openeye Name: [(1'R,2'R,4'S)-1',7',7'-trimethylspiro[indane-2,3'-norbornane]-2'-yl] 2-benzyl-3-methyl-butanoate CAS Name: 3-methyl-2-(phenylmethyl)butanoic acid [(1'S,3'R,4'R)-4',7',7'-trimethyl-3'-spiro[1,3-dihydroindene-2,2'-bicyclo[2.2.1]heptane]yl] ester IUPAC Name: [(1'S,3'R,4'R)-4',7',7'-trimethylspiro[1,3-dihydroindene-2,2'-bicyclo[2.2.1]heptane]-3'-yl] 2-benzyl-3-methylbutanoate Traditional Name: 2-benzyl-3-methyl-butyric acid [(1'R,2'R,4'S)-1',7',7'-trimethylspiro[indane-2,3'-norbornane]-2'-yl] ester Formula: C30H38O2 MolecularWeight: 430.62152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=CC=CC=C1)C(=O)OC2C3(CCC(C3(C)C)C24CC5=CC=CC=C5C4)C

Isomeric SMILES

CC(C)C(CC1=CC=CC=C1)C(=O)O[C@H]2[C@@]3(CC[C@@H](C3(C)C)C24CC5=CC=CC=C5C4)C

InChI

InChI=1S/C30H38O2/c1-20(2)24(17-21-11-7-6-8-12-21)26(31)32-27-29(5)16-15-25(28(29,3)4)30(27)18-22-13-9-10-14-23(22)19-30/h6-14,20,24-25,27H,15-19H2,1-5H3/t24?,25-,27-,29-/m0/s1