methyl (E)-2-[2-(5-chloranylpyridin-2-yl)sulfanylphenyl]-3-oxidanyl-prop-2-enoate

Systemtic Name: methyl (E)-2-[2-(5-chloranylpyridin-2-yl)sulfanylphenyl]-3-oxidanyl-prop-2-enoate Openeye Name: methyl (E)-2-[2-[(5-chloro-2-pyridyl)sulfanyl]phenyl]-3-hydroxy-prop-2-enoate CAS Name: (E)-2-[2-[(5-chloro-2-pyridinyl)thio]phenyl]-3-hydroxy-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-[2-(5-chloropyridin-2-yl)sulfanylphenyl]-3-hydroxyprop-2-enoate Traditional Name: (E)-2-[2-[(5-chloro-2-pyridyl)thio]phenyl]-3-hydroxy-acrylic acid methyl ester Formula: C15H12ClNO3S MolecularWeight: 321.77868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CO)C1=CC=CC=C1SC2=NC=C(C=C2)Cl

Isomeric SMILES

COC(=O)/C(=C/O)/C1=CC=CC=C1SC2=NC=C(C=C2)Cl

InChI

InChI=1S/C15H12ClNO3S/c1-20-15(19)12(9-18)11-4-2-3-5-13(11)21-14-7-6-10(16)8-17-14/h2-9,18H,1H3/b12-9+