[17-(2-chloranylethynyl)-13-ethyl-3-oxidanyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ethanoate

Systemtic Name: [17-(2-chloranylethynyl)-13-ethyl-3-oxidanyl-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ethanoate Openeye Name: [17-(2-chloroethynyl)-13-ethyl-3-hydroxy-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate CAS Name: acetic acid [17-(2-chloroethynyl)-13-ethyl-3-hydroxy-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ester IUPAC Name: [17-(2-chloroethynyl)-13-ethyl-3-hydroxy-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate Traditional Name: acetic acid [17-(2-chloroethynyl)-13-ethyl-3-hydroxy-2,3,6,7,8,9,10,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] ester Formula: C23H31ClO3 MolecularWeight: 390.94344

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CCC3C(C1CCC2(C#CCl)OC(=O)C)CCC4=CC(CCC34)O

Isomeric SMILES

CCC12CCC3C(C1CCC2(C#CCl)OC(=O)C)CCC4=CC(CCC34)O

InChI

InChI=1S/C23H31ClO3/c1-3-22-10-8-19-18-7-5-17(26)14-16(18)4-6-20(19)21(22)9-11-23(22,12-13-24)27-15(2)25/h14,17-21,26H,3-11H2,1-2H3