[(8S,9S,11S,13S,14S)-16-chloranyl-11-ethoxy-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ethanoate

Systemtic Name: [(8S,9S,11S,13S,14S)-16-chloranyl-11-ethoxy-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ethanoate Openeye Name: [(8S,9S,11S,13S,14S)-16-chloro-11-ethoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] acetate CAS Name: acetic acid [(8S,9S,11S,13S,14S)-16-chloro-11-ethoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester IUPAC Name: [(8S,9S,11S,13S,14S)-16-chloro-11-ethoxy-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] acetate Traditional Name: acetic acid [(8S,9S,11S,13S,14S)-16-chloro-11-ethoxy-17-keto-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester Formula: C22H27ClO4 MolecularWeight: 390.90038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC2(C(CC(C2=O)Cl)C3C1C4=C(CC3)C=C(C=C4)OC(=O)C)C

Isomeric SMILES

CCO[C@H]1C[C@]2([C@@H](CC(C2=O)Cl)[C@H]3[C@H]1C4=C(CC3)C=C(C=C4)OC(=O)C)C

InChI

InChI=1S/C22H27ClO4/c1-4-26-19-11-22(3)17(10-18(23)21(22)25)16-7-5-13-9-14(27-12(2)24)6-8-15(13)20(16)19/h6,8-9,16-20H,4-5,7,10-11H2,1-3H3/t16-,17-,18?,19-,20+,22-/m0/s1