5-[2-(3-chloranyl-2-methyl-phenyl)sulfanylethyl]-2-[(2E)-2-ethoxyiminopropyl]-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 5-[2-(3-chloranyl-2-methyl-phenyl)sulfanylethyl]-2-[(2E)-2-ethoxyiminopropyl]-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 5-[2-(3-chloro-2-methyl-phenyl)sulfanylethyl]-2-[(2E)-2-ethoxyiminopropyl]-3-hydroxy-cyclohex-2-en-1-one CAS Name: 5-[2-[(3-chloro-2-methylphenyl)thio]ethyl]-2-[(2E)-2-ethoxyiminopropyl]-3-hydroxy-1-cyclohex-2-enone IUPAC Name: 5-[2-(3-chloro-2-methylphenyl)sulfanylethyl]-2-[(2E)-2-ethoxyiminopropyl]-3-hydroxycyclohex-2-en-1-one Traditional Name: 5-[2-[(3-chloro-2-methyl-phenyl)thio]ethyl]-2-[(2E)-2-ethyloximinopropyl]-3-hydroxy-cyclohex-2-en-1-one Formula: C20H26ClNO3S MolecularWeight: 395.94334

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C(C)CC1=C(CC(CC1=O)CCSC2=C(C(=CC=C2)Cl)C)O

Isomeric SMILES

CCO/N=C(\C)/CC1=C(CC(CC1=O)CCSC2=C(C(=CC=C2)Cl)C)O

InChI

InChI=1S/C20H26ClNO3S/c1-4-25-22-13(2)10-16-18(23)11-15(12-19(16)24)8-9-26-20-7-5-6-17(21)14(20)3/h5-7,15,23H,4,8-12H2,1-3H3/b22-13+