1-(2-chloranyl-5-sulfanyl-phenyl)-3-ethoxy-3-oxidanyl-2-(phenylmethyl)prop-2-en-1-one

Systemtic Name: 1-(2-chloranyl-5-sulfanyl-phenyl)-3-ethoxy-3-oxidanyl-2-(phenylmethyl)prop-2-en-1-one Openeye Name: 2-benzyl-1-(2-chloro-5-sulfanyl-phenyl)-3-ethoxy-3-hydroxy-prop-2-en-1-one CAS Name: 1-(2-chloro-5-mercaptophenyl)-3-ethoxy-3-hydroxy-2-(phenylmethyl)-2-propen-1-one IUPAC Name: 2-benzyl-1-(2-chloro-5-sulfanylphenyl)-3-ethoxy-3-hydroxyprop-2-en-1-one Traditional Name: 2-benzyl-1-(2-chloro-5-mercapto-phenyl)-3-ethoxy-3-hydroxy-prop-2-en-1-one Formula: C18H17ClO3S MolecularWeight: 348.84378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(CC1=CC=CC=C1)C(=O)C2=C(C=CC(=C2)S)Cl)O

Isomeric SMILES

CCOC(=C(CC1=CC=CC=C1)C(=O)C2=C(C=CC(=C2)S)Cl)O

InChI

InChI=1S/C18H17ClO3S/c1-2-22-18(21)15(10-12-6-4-3-5-7-12)17(20)14-11-13(23)8-9-16(14)19/h3-9,11,21,23H,2,10H2,1H3