(8R,9S,10R,13S,14S,17S)-13-ethyl-3-oxidanylidene-2,8,9,10,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile

Systemtic Name: (8R,9S,10R,13S,14S,17S)-13-ethyl-3-oxidanylidene-2,8,9,10,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile Openeye Name: (8R,9S,10R,13S,14S,17S)-13-ethyl-3-oxo-2,8,9,10,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile CAS Name: (8R,9S,10R,13S,14S,17S)-13-ethyl-3-oxo-2,8,9,10,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile IUPAC Name: (8R,9S,10R,13S,14S,17S)-13-ethyl-3-oxo-2,8,9,10,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile Traditional Name: (8R,9S,10R,13S,14S,17S)-13-ethyl-3-keto-2,8,9,10,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile Formula: C20H25NO MolecularWeight: 295.4186

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CCC3C4CCC(=O)C=C4C=CC3C1CCC2C#N

Isomeric SMILES

CC[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4C=C[C@H]3[C@@H]1CC[C@@H]2C#N

InChI

InChI=1S/C20H25NO/c1-2-20-10-9-17-16-7-5-15(22)11-13(16)3-6-18(17)19(20)8-4-14(20)12-21/h3,6,11,14,16-19H,2,4-5,7-10H2,1H3/t14-,16+,17-,18-,19+,20-/m1/s1