2-methylidene-4-phenylmethoxy-3-[(E)-1-phenylsulfanyloct-2-enyl]cyclopentan-1-one

Systemtic Name: 2-methylidene-4-phenylmethoxy-3-[(E)-1-phenylsulfanyloct-2-enyl]cyclopentan-1-one Openeye Name: 4-benzyloxy-2-methylene-3-[(E)-1-phenylsulfanyloct-2-enyl]cyclopentanone CAS Name: 2-methylene-4-phenylmethoxy-3-[(E)-1-(phenylthio)oct-2-enyl]-1-cyclopentanone IUPAC Name: 2-methylidene-4-phenylmethoxy-3-[(E)-1-phenylsulfanyloct-2-enyl]cyclopentan-1-one Traditional Name: 4-benzoxy-2-methylene-3-[(E)-1-(phenylthio)oct-2-enyl]cyclopentanone Formula: C27H32O2S MolecularWeight: 420.60678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC(C1C(CC(=O)C1=C)OCC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCCCC/C=C/C(C1C(CC(=O)C1=C)OCC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C27H32O2S/c1-3-4-5-6-13-18-26(30-23-16-11-8-12-17-23)27-21(2)24(28)19-25(27)29-20-22-14-9-7-10-15-22/h7-18,25-27H,2-6,19-20H2,1H3/b18-13+