[(3S)-3-[(E)-6-chloranylhex-4-en-3-yl]oxy-1-(phenylsulfonyl)nonyl]sulfonylbenzene

Systemtic Name: [(3S)-3-[(E)-6-chloranylhex-4-en-3-yl]oxy-1-(phenylsulfonyl)nonyl]sulfonylbenzene Openeye Name: [(3S)-1-(benzenesulfonyl)-3-[(E)-4-chloro-1-ethyl-but-2-enoxy]nonyl]sulfonylbenzene CAS Name: [(3S)-1-(benzenesulfonyl)-3-[(E)-6-chlorohex-4-en-3-yl]oxynonyl]sulfonylbenzene IUPAC Name: [(3S)-1-(benzenesulfonyl)-3-[(E)-6-chlorohex-4-en-3-yl]oxynonyl]sulfonylbenzene Traditional Name: [(3S)-1-besyl-3-[(E)-4-chloro-1-ethyl-but-2-enoxy]nonyl]sulfonylbenzene Formula: C27H37ClO5S2 MolecularWeight: 541.16268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)OC(CC)C=CCCl

Isomeric SMILES

CCCCCC[C@@H](CC(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)OC(CC)/C=C/CCl

InChI

InChI=1S/C27H37ClO5S2/c1-3-5-6-9-15-24(33-23(4-2)16-14-21-28)22-27(34(29,30)25-17-10-7-11-18-25)35(31,32)26-19-12-8-13-20-26/h7-8,10-14,16-20,23-24,27H,3-6,9,15,21-22H2,1-2H3/b16-14+/t23?,24-/m0/s1