ethyl (8R,9S,10R,13S,14S,17R)-17-[2,2-bis(chloranyl)ethanoyloxy]-10,13-dimethyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate

Systemtic Name: ethyl (8R,9S,10R,13S,14S,17R)-17-[2,2-bis(chloranyl)ethanoyloxy]-10,13-dimethyl-3-oxidanylidene-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate Openeye Name: ethyl (8R,9S,10R,13S,14S,17R)-17-(2,2-dichloroacetyl)oxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate CAS Name: (8R,9S,10R,13S,14S,17R)-17-(2,2-dichloro-1-oxoethoxy)-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid ethyl ester IUPAC Name: ethyl (8R,9S,10R,13S,14S,17R)-17-(2,2-dichloroacetyl)oxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate Traditional Name: (8R,9S,10R,13S,14S,17R)-17-(2,2-dichloroacetyl)oxy-3-keto-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17-carboxylic acid ethyl ester Formula: C24H32Cl2O5 MolecularWeight: 471.41388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)OC(=O)C(Cl)Cl

Isomeric SMILES

CCOC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)OC(=O)C(Cl)Cl

InChI

InChI=1S/C24H32Cl2O5/c1-4-30-21(29)24(31-20(28)19(25)26)12-9-18-16-6-5-14-13-15(27)7-10-22(14,2)17(16)8-11-23(18,24)3/h13,16-19H,4-12H2,1-3H3/t16-,17+,18+,22+,23+,24+/m1/s1