methyl 7-[2-acetyloxy-5-[(E)-5-methyl-3-oxidanylidene-non-1-enyl]cyclopentyl]-2-phenylselanyl-heptanoate

Systemtic Name: methyl 7-[2-acetyloxy-5-[(E)-5-methyl-3-oxidanylidene-non-1-enyl]cyclopentyl]-2-phenylselanyl-heptanoate Openeye Name: methyl 7-[2-acetoxy-5-[(E)-5-methyl-3-oxo-non-1-enyl]cyclopentyl]-2-phenylselanyl-heptanoate CAS Name: 7-[2-acetyloxy-5-[(E)-5-methyl-3-oxonon-1-enyl]cyclopentyl]-2-(phenylseleno)heptanoic acid methyl ester IUPAC Name: methyl 7-[2-acetyloxy-5-[(E)-5-methyl-3-oxonon-1-enyl]cyclopentyl]-2-phenylselanylheptanoate Traditional Name: 7-[2-acetoxy-5-[(E)-3-keto-5-methyl-non-1-enyl]cyclopentyl]-2-(phenylseleno)enanthic acid methyl ester Formula: C31H46O5Se MolecularWeight: 577.65394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC(=O)C=CC1CCC(C1CCCCCC(C(=O)OC)[Se]C2=CC=CC=C2)OC(=O)C

Isomeric SMILES

CCCCC(C)CC(=O)/C=C/C1CCC(C1CCCCCC(C(=O)OC)[Se]C2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C31H46O5Se/c1-5-6-13-23(2)22-26(33)20-18-25-19-21-29(36-24(3)32)28(25)16-11-8-12-17-30(31(34)35-4)37-27-14-9-7-10-15-27/h7,9-10,14-15,18,20,23,25,28-30H,5-6,8,11-13,16-17,19,21-22H2,1-4H3/b20-18+