[(15S,16R)-15-acetyloxy-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] ethanoate

Systemtic Name: [(15S,16R)-15-acetyloxy-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] ethanoate Openeye Name: [(15S,16R)-15-acetoxy-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] acetate CAS Name: acetic acid [(15S,16R)-15-acetyloxy-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] ester IUPAC Name: [(15S,16R)-15-acetyloxy-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] acetate Traditional Name: acetic acid [(15S,16R)-15-acetoxy-16,17-dihydro-15H-cyclopenta[a]phenanthren-16-yl] ester Formula: C21H18O4 MolecularWeight: 334.36522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC2=C(C1OC(=O)C)C3=C(C=C2)C4=CC=CC=C4C=C3

Isomeric SMILES

CC(=O)O[C@@H]1CC2=C([C@@H]1OC(=O)C)C3=C(C=C2)C4=CC=CC=C4C=C3

InChI

InChI=1S/C21H18O4/c1-12(22)24-19-11-15-8-9-17-16-6-4-3-5-14(16)7-10-18(17)20(15)21(19)25-13(2)23/h3-10,19,21H,11H2,1-2H3/t19-,21-/m1/s1