[17-acetyloxy-17-(2-chloranylethynyl)-13-ethyl-2,7,8,9,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate

Systemtic Name: [17-acetyloxy-17-(2-chloranylethynyl)-13-ethyl-2,7,8,9,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ethanoate Openeye Name: [17-acetoxy-17-(2-chloroethynyl)-13-ethyl-2,7,8,9,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate CAS Name: acetic acid [17-acetyloxy-17-(2-chloroethynyl)-13-ethyl-2,7,8,9,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [17-acetyloxy-17-(2-chloroethynyl)-13-ethyl-2,7,8,9,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate Traditional Name: acetic acid [17-acetoxy-17-(2-chloroethynyl)-13-ethyl-2,7,8,9,10,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-yl] ester Formula: C25H31ClO4 MolecularWeight: 430.96424

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CCC3C4CCC(=CC4=CCC3C1CCC2(C#CCl)OC(=O)C)OC(=O)C

Isomeric SMILES

CCC12CCC3C4CCC(=CC4=CCC3C1CCC2(C#CCl)OC(=O)C)OC(=O)C

InChI

InChI=1S/C25H31ClO4/c1-4-24-11-9-21-20-8-6-19(29-16(2)27)15-18(20)5-7-22(21)23(24)10-12-25(24,13-14-26)30-17(3)28/h5,15,20-23H,4,6-12H2,1-3H3