[2-[4-chloranyl-10,13-dimethyl-17-oxidanyl-3,11-bis(oxidanylidene)-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] ethanoate

Systemtic Name: [2-[4-chloranyl-10,13-dimethyl-17-oxidanyl-3,11-bis(oxidanylidene)-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethyl] ethanoate Openeye Name: [2-(4-chloro-17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-ethyl] acetate CAS Name: acetic acid [2-(4-chloro-17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate Traditional Name: acetic acid [2-(4-chloro-17-hydroxy-3,11-diketo-10,13-dimethyl-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-keto-ethyl] ester Formula: C23H31ClO6 MolecularWeight: 438.94164

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=O)C1(CCC2C1(CC(=O)C3C2CCC4C3(CCC(=O)C4Cl)C)C)O

Isomeric SMILES

CC(=O)OCC(=O)C1(CCC2C1(CC(=O)C3C2CCC4C3(CCC(=O)C4Cl)C)C)O

InChI

InChI=1S/C23H31ClO6/c1-12(25)30-11-18(28)23(29)9-6-14-13-4-5-15-20(24)16(26)7-8-21(15,2)19(13)17(27)10-22(14,23)3/h13-15,19-20,29H,4-11H2,1-3H3