8-bromanyl-5,6-bis(chloranyl)-4a-ethyl-3-methyl-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol

Systemtic Name: 8-bromanyl-5,6-bis(chloranyl)-4a-ethyl-3-methyl-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol Openeye Name: 8-bromo-5,6-dichloro-4a-ethyl-3-methyl-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol CAS Name: 8-bromo-5,6-dichloro-4a-ethyl-3-methyl-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol IUPAC Name: 8-bromo-5,6-dichloro-4a-ethyl-3-methyl-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol Traditional Name: 8-bromo-5,6-dichloro-4a-ethyl-3-methyl-2-phenyl-4,9,10,10a-tetrahydro-1H-phenanthrene-2,3,7-triol Formula: C23H25BrCl2O3 MolecularWeight: 500.2528

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CC(C(CC1CCC3=C2C(=C(C(=C3Br)O)Cl)Cl)(C4=CC=CC=C4)O)(C)O

Isomeric SMILES

CCC12CC(C(CC1CCC3=C2C(=C(C(=C3Br)O)Cl)Cl)(C4=CC=CC=C4)O)(C)O

InChI

InChI=1S/C23H25BrCl2O3/c1-3-22-12-21(2,28)23(29,13-7-5-4-6-8-13)11-14(22)9-10-15-16(22)18(25)19(26)20(27)17(15)24/h4-8,14,27-29H,3,9-12H2,1-2H3