2-(3-chloranyl-4-sulfanyl-phenyl)-1-(4-oxidanylpiperidin-1-yl)prop-2-en-1-one

Systemtic Name: 2-(3-chloranyl-4-sulfanyl-phenyl)-1-(4-oxidanylpiperidin-1-yl)prop-2-en-1-one Openeye Name: 2-(3-chloro-4-sulfanyl-phenyl)-1-(4-hydroxy-1-piperidyl)prop-2-en-1-one CAS Name: 2-(3-chloro-4-mercaptophenyl)-1-(4-hydroxy-1-piperidinyl)-2-propen-1-one IUPAC Name: 2-(3-chloro-4-sulfanylphenyl)-1-(4-hydroxypiperidin-1-yl)prop-2-en-1-one Traditional Name: 2-(3-chloro-4-mercapto-phenyl)-1-(4-hydroxypiperidino)prop-2-en-1-one Formula: C14H16ClNO2S MolecularWeight: 297.80034

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC(=C(C=C1)S)Cl)C(=O)N2CCC(CC2)O

Isomeric SMILES

C=C(C1=CC(=C(C=C1)S)Cl)C(=O)N2CCC(CC2)O

InChI

InChI=1S/C14H16ClNO2S/c1-9(10-2-3-13(19)12(15)8-10)14(18)16-6-4-11(17)5-7-16/h2-3,8,11,17,19H,1,4-7H2