17-(2-bromanylethanoyl)-10,13-dimethyl-17-oxidanyl-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,11-dione

Systemtic Name: 17-(2-bromanylethanoyl)-10,13-dimethyl-17-oxidanyl-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,11-dione Openeye Name: 17-(2-bromoacetyl)-17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,11-dione CAS Name: 17-(2-bromo-1-oxoethyl)-17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,11-dione IUPAC Name: 17-(2-bromoacetyl)-17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,11-dione Traditional Name: 17-(2-bromoacetyl)-17-hydroxy-10,13-dimethyl-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,11-quinone Formula: C21H29BrO4 MolecularWeight: 425.35656

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(=O)CC1CCC3C2C(=O)CC4(C3CCC4(C(=O)CBr)O)C

Isomeric SMILES

CC12CCC(=O)CC1CCC3C2C(=O)CC4(C3CCC4(C(=O)CBr)O)C

InChI

InChI=1S/C21H29BrO4/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12,14-15,18,26H,3-11H2,1-2H3