(Z,3R,6S)-6-[(3-chlorophenyl)methylsulfonyl]-4-methyl-1-phenyl-3-phenylmethoxy-hept-4-en-1-one

Systemtic Name: (Z,3R,6S)-6-[(3-chlorophenyl)methylsulfonyl]-4-methyl-1-phenyl-3-phenylmethoxy-hept-4-en-1-one Openeye Name: (Z,3R,6S)-3-benzyloxy-6-[(3-chlorophenyl)methylsulfonyl]-4-methyl-1-phenyl-hept-4-en-1-one CAS Name: (Z,3R,6S)-6-[(3-chlorophenyl)methylsulfonyl]-4-methyl-1-phenyl-3-phenylmethoxy-4-hepten-1-one IUPAC Name: (Z,3R,6S)-6-[(3-chlorophenyl)methylsulfonyl]-4-methyl-1-phenyl-3-phenylmethoxyhept-4-en-1-one Traditional Name: (Z,3R,6S)-3-benzoxy-6-(3-chlorobenzyl)sulfonyl-4-methyl-1-phenyl-hept-4-en-1-one Formula: C28H29ClO4S MolecularWeight: 497.04546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=C(C)C(CC(=O)C1=CC=CC=C1)OCC2=CC=CC=C2)S(=O)(=O)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C[C@@H](/C=C(/C)\[C@@H](CC(=O)C1=CC=CC=C1)OCC2=CC=CC=C2)S(=O)(=O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C28H29ClO4S/c1-21(16-22(2)34(31,32)20-24-12-9-15-26(29)17-24)28(33-19-23-10-5-3-6-11-23)18-27(30)25-13-7-4-8-14-25/h3-17,22,28H,18-20H2,1-2H3/b21-16-/t22-,28+/m0/s1