4-[[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-sulfanyl-methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-sulfanyl-methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-sulfanyl-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-mercaptomethylidene]-2-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-sulfanylmethylidene]-2-methoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[4-(4-chlorophenyl)-4-hydroxy-piperidino]-mercapto-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C19H20ClNO3S MolecularWeight: 377.885

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(N2CCC(CC2)(C3=CC=C(C=C3)Cl)O)S)C=CC1=O

Isomeric SMILES

COC1=CC(=C(N2CCC(CC2)(C3=CC=C(C=C3)Cl)O)S)C=CC1=O

InChI

InChI=1S/C19H20ClNO3S/c1-24-17-12-13(2-7-16(17)22)18(25)21-10-8-19(23,9-11-21)14-3-5-15(20)6-4-14/h2-7,12,23,25H,8-11H2,1H3