(13-ethyl-17-oxidanylidene-7,11,12,16-tetrahydro-6H-cyclopenta[a]phenanthren-3-yl) ethanoate

Systemtic Name: (13-ethyl-17-oxidanylidene-7,11,12,16-tetrahydro-6H-cyclopenta[a]phenanthren-3-yl) ethanoate Openeye Name: (13-ethyl-17-oxo-7,11,12,16-tetrahydro-6H-cyclopenta[a]phenanthren-3-yl) acetate CAS Name: acetic acid (13-ethyl-17-oxo-7,11,12,16-tetrahydro-6H-cyclopenta[a]phenanthren-3-yl) ester IUPAC Name: (13-ethyl-17-oxo-7,11,12,16-tetrahydro-6H-cyclopenta[a]phenanthren-3-yl) acetate Traditional Name: acetic acid (13-ethyl-17-keto-7,11,12,16-tetrahydro-6H-cyclopenta[a]phenanthren-3-yl) ester Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CCC3=C(C1=CCC2=O)CCC4=C3C=CC(=C4)OC(=O)C

Isomeric SMILES

CCC12CCC3=C(C1=CCC2=O)CCC4=C3C=CC(=C4)OC(=O)C

InChI

InChI=1S/C21H22O3/c1-3-21-11-10-17-16-7-5-15(24-13(2)22)12-14(16)4-6-18(17)19(21)8-9-20(21)23/h5,7-8,12H,3-4,6,9-11H2,1-2H3