2-[(5S,6R)-6-azidodecan-5-yl]selanyl-1-methoxy-3-[(1S)-1-methylsulfanylethyl]benzene

Systemtic Name: 2-[(5S,6R)-6-azidodecan-5-yl]selanyl-1-methoxy-3-[(1S)-1-methylsulfanylethyl]benzene Openeye Name: 2-[(1S,2R)-2-azido-1-butyl-hexyl]selanyl-1-methoxy-3-[(1S)-1-methylsulfanylethyl]benzene CAS Name: 2-[[(5S,6R)-6-azidodecan-5-yl]seleno]-1-methoxy-3-[(1S)-1-(methylthio)ethyl]benzene IUPAC Name: 2-[(5S,6R)-6-azidodecan-5-yl]selanyl-1-methoxy-3-[(1S)-1-methylsulfanylethyl]benzene Traditional Name: 2-[[(1S,2R)-2-azido-1-butyl-hexyl]seleno]-1-methoxy-3-[(1S)-1-(methylthio)ethyl]benzene Formula: C20H33N3OSSe MolecularWeight: 442.52052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CCCC)[Se]C1=C(C=CC=C1OC)C(C)SC)N=[N+]=[N-]

Isomeric SMILES

CCCC[C@H]([C@H](CCCC)[Se]C1=C(C=CC=C1OC)[C@H](C)SC)N=[N+]=[N-]

InChI

InChI=1S/C20H33N3OSSe/c1-6-8-12-17(22-23-21)19(14-9-7-2)26-20-16(15(3)25-5)11-10-13-18(20)24-4/h10-11,13,15,17,19H,6-9,12,14H2,1-5H3/t15-,17+,19-/m0/s1