methyl 2-chloranyl-4-methylsulfonyl-3-prop-2-ynoxy-benzoate

Systemtic Name: methyl 2-chloranyl-4-methylsulfonyl-3-prop-2-ynoxy-benzoate Openeye Name: methyl 2-chloro-4-methylsulfonyl-3-prop-2-ynoxy-benzoate CAS Name: 2-chloro-4-methylsulfonyl-3-prop-2-ynoxybenzoic acid methyl ester IUPAC Name: methyl 2-chloro-4-methylsulfonyl-3-prop-2-ynoxybenzoate Traditional Name: 2-chloro-4-mesyl-3-propargyloxy-benzoic acid methyl ester Formula: C12H11ClO5S MolecularWeight: 302.73074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=C(C=C1)S(=O)(=O)C)OCC#C)Cl

Isomeric SMILES

COC(=O)C1=C(C(=C(C=C1)S(=O)(=O)C)OCC#C)Cl

InChI

InChI=1S/C12H11ClO5S/c1-4-7-18-11-9(19(3,15)16)6-5-8(10(11)13)12(14)17-2/h1,5-6H,7H2,2-3H3