2-(3-chloranyl-4-sulfanyl-phenyl)-1-[3-(hydroxymethyl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: 2-(3-chloranyl-4-sulfanyl-phenyl)-1-[3-(hydroxymethyl)piperidin-1-yl]prop-2-en-1-one Openeye Name: 2-(3-chloro-4-sulfanyl-phenyl)-1-[3-(hydroxymethyl)-1-piperidyl]prop-2-en-1-one CAS Name: 2-(3-chloro-4-mercaptophenyl)-1-[3-(hydroxymethyl)-1-piperidinyl]-2-propen-1-one IUPAC Name: 2-(3-chloro-4-sulfanylphenyl)-1-[3-(hydroxymethyl)piperidin-1-yl]prop-2-en-1-one Traditional Name: 2-(3-chloro-4-mercapto-phenyl)-1-(3-methylolpiperidino)prop-2-en-1-one Formula: C15H18ClNO2S MolecularWeight: 311.82692

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC(=C(C=C1)S)Cl)C(=O)N2CCCC(C2)CO

Isomeric SMILES

C=C(C1=CC(=C(C=C1)S)Cl)C(=O)N2CCCC(C2)CO

InChI

InChI=1S/C15H18ClNO2S/c1-10(12-4-5-14(20)13(16)7-12)15(19)17-6-2-3-11(8-17)9-18/h4-5,7,11,18,20H,1-3,6,8-9H2