[(3S,5S,8R,9S,10S,13S,14S,17S)-2',2'-bis(chloranyl)-10,13-dimethyl-3'-oxidanylidene-spiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,1'-cyclobutane]-3-yl] ethanoate

Systemtic Name: [(3S,5S,8R,9S,10S,13S,14S,17S)-2',2'-bis(chloranyl)-10,13-dimethyl-3'-oxidanylidene-spiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,1'-cyclobutane]-3-yl] ethanoate Openeye Name: [(3S,5S,8R,9S,10S,13S,14S,17S)-2',2'-dichloro-10,13-dimethyl-3'-oxo-spiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,1'-cyclobutane]-3-yl] acetate CAS Name: acetic acid [(3S,5S,8R,9S,10S,13S,14S,17S)-2',2'-dichloro-10,13-dimethyl-3'-oxo-3-spiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,1'-cyclobutane]yl] ester IUPAC Name: [(3S,5S,8R,9S,10S,13S,14S,17S)-2',2'-dichloro-10,13-dimethyl-3'-oxospiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,1'-cyclobutane]-3-yl] acetate Traditional Name: acetic acid [(3S,5S,8R,9S,10S,13S,14S,17S)-2',2'-dichloro-3'-keto-10,13-dimethyl-spiro[1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-17,1'-cyclobutane]-3-yl] ester Formula: C24H34Cl2O3 MolecularWeight: 441.43096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3CCC45CC(=O)C5(Cl)Cl)C)C

Isomeric SMILES

CC(=O)O[C@H]1CC[C@]2([C@H](C1)CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]45CC(=O)C5(Cl)Cl)C)C

InChI

InChI=1S/C24H34Cl2O3/c1-14(27)29-16-6-9-21(2)15(12-16)4-5-17-18(21)7-10-22(3)19(17)8-11-23(22)13-20(28)24(23,25)26/h15-19H,4-13H2,1-3H3/t15-,16-,17+,18-,19-,21-,22-,23-/m0/s1