(5Z)-5-octylidene-4-oxidanyl-4-(4-phenoxybutyl)-2-(phenylsulfinyl)cyclopent-2-en-1-one

Systemtic Name: (5Z)-5-octylidene-4-oxidanyl-4-(4-phenoxybutyl)-2-(phenylsulfinyl)cyclopent-2-en-1-one Openeye Name: (5Z)-2-(benzenesulfinyl)-4-hydroxy-5-octylidene-4-(4-phenoxybutyl)cyclopent-2-en-1-one CAS Name: (5Z)-2-(benzenesulfinyl)-4-hydroxy-5-octylidene-4-(4-phenoxybutyl)-1-cyclopent-2-enone IUPAC Name: (5Z)-2-(benzenesulfinyl)-4-hydroxy-5-octylidene-4-(4-phenoxybutyl)cyclopent-2-en-1-one Traditional Name: (5Z)-2-(benzenesulfinyl)-4-hydroxy-5-octylidene-4-(4-phenoxybutyl)cyclopent-2-en-1-one Formula: C29H36O4S MolecularWeight: 480.65874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC=C1C(=O)C(=CC1(CCCCOC2=CC=CC=C2)O)S(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCC/C=C/1\C(=O)C(=CC1(CCCCOC2=CC=CC=C2)O)S(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H36O4S/c1-2-3-4-5-6-13-20-26-28(30)27(34(32)25-18-11-8-12-19-25)23-29(26,31)21-14-15-22-33-24-16-9-7-10-17-24/h7-12,16-20,23,31H,2-6,13-15,21-22H2,1H3/b26-20+