1-chloranyl-13-oxidanyl-1-(phenylsulfinyl)tridecan-2-one

Systemtic Name: 1-chloranyl-13-oxidanyl-1-(phenylsulfinyl)tridecan-2-one Openeye Name: 1-(benzenesulfinyl)-1-chloro-13-hydroxy-tridecan-2-one CAS Name: 1-(benzenesulfinyl)-1-chloro-13-hydroxy-2-tridecanone IUPAC Name: 1-(benzenesulfinyl)-1-chloro-13-hydroxytridecan-2-one Traditional Name: 1-(benzenesulfinyl)-1-chloro-13-hydroxy-tridecan-2-one Formula: C19H29ClO3S MolecularWeight: 372.94976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)C(C(=O)CCCCCCCCCCCO)Cl

Isomeric SMILES

C1=CC=C(C=C1)S(=O)C(C(=O)CCCCCCCCCCCO)Cl

InChI

InChI=1S/C19H29ClO3S/c20-19(24(23)17-13-9-8-10-14-17)18(22)15-11-6-4-2-1-3-5-7-12-16-21/h8-10,13-14,19,21H,1-7,11-12,15-16H2