(Z,4R,7S)-7-[(3-chlorophenyl)methylsulfonyl]-5-methyl-4-phenylmethoxy-oct-5-en-2-one

Systemtic Name: (Z,4R,7S)-7-[(3-chlorophenyl)methylsulfonyl]-5-methyl-4-phenylmethoxy-oct-5-en-2-one Openeye Name: (Z,4R,7S)-4-benzyloxy-7-[(3-chlorophenyl)methylsulfonyl]-5-methyl-oct-5-en-2-one CAS Name: (Z,4R,7S)-7-[(3-chlorophenyl)methylsulfonyl]-5-methyl-4-phenylmethoxy-5-octen-2-one IUPAC Name: (Z,4R,7S)-7-[(3-chlorophenyl)methylsulfonyl]-5-methyl-4-phenylmethoxyoct-5-en-2-one Traditional Name: (Z,4R,7S)-4-benzoxy-7-(3-chlorobenzyl)sulfonyl-5-methyl-oct-5-en-2-one Formula: C23H27ClO4S MolecularWeight: 434.97608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C(C)C(CC(=O)C)OCC1=CC=CC=C1)S(=O)(=O)CC2=CC(=CC=C2)Cl

Isomeric SMILES

C[C@@H](/C=C(/C)\[C@@H](CC(=O)C)OCC1=CC=CC=C1)S(=O)(=O)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C23H27ClO4S/c1-17(23(13-18(2)25)28-15-20-8-5-4-6-9-20)12-19(3)29(26,27)16-21-10-7-11-22(24)14-21/h4-12,14,19,23H,13,15-16H2,1-3H3/b17-12-/t19-,23+/m0/s1