ethyl (1S,2S,4S)-1-[bis(phenylselanyl)methyl]-2-cyano-4-methoxy-4-methyl-cyclopentane-1-carboxylate

Systemtic Name: ethyl (1S,2S,4S)-1-[bis(phenylselanyl)methyl]-2-cyano-4-methoxy-4-methyl-cyclopentane-1-carboxylate Openeye Name: ethyl (1S,2S,4S)-1-[bis(phenylselanyl)methyl]-2-cyano-4-methoxy-4-methyl-cyclopentanecarboxylate CAS Name: (1S,2S,4S)-1-[bis(phenylseleno)methyl]-2-cyano-4-methoxy-4-methyl-1-cyclopentanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S,4S)-1-[bis(phenylselanyl)methyl]-2-cyano-4-methoxy-4-methylcyclopentane-1-carboxylate Traditional Name: (1S,2S,4S)-1-[bis(phenylseleno)methyl]-2-cyano-4-methoxy-4-methyl-cyclopentanecarboxylic acid ethyl ester Formula: C24H27NO3Se2 MolecularWeight: 535.39608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(CC1C#N)(C)OC)C([Se]C2=CC=CC=C2)[Se]C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@]1(C[C@@](C[C@@H]1C#N)(C)OC)C([Se]C2=CC=CC=C2)[Se]C3=CC=CC=C3

InChI

InChI=1S/C24H27NO3Se2/c1-4-28-21(26)24(17-23(2,27-3)15-18(24)16-25)22(29-19-11-7-5-8-12-19)30-20-13-9-6-10-14-20/h5-14,18,22H,4,15,17H2,1-3H3/t18-,23+,24+/m1/s1