1-[2-(4-chloranyl-2-fluoranyl-3-methyl-phenoxy)-4-methylsulfonyl-phenyl]-N-methyl-methanamine

Systemtic Name: 1-[2-(4-chloranyl-2-fluoranyl-3-methyl-phenoxy)-4-methylsulfonyl-phenyl]-N-methyl-methanamine Openeye Name: 1-[2-(4-chloro-2-fluoro-3-methyl-phenoxy)-4-methylsulfonyl-phenyl]-N-methyl-methanamine CAS Name: 1-[2-(4-chloro-2-fluoro-3-methylphenoxy)-4-methylsulfonylphenyl]-N-methylmethanamine IUPAC Name: 1-[2-(4-chloro-2-fluoro-3-methylphenoxy)-4-methylsulfonylphenyl]-N-methylmethanamine Traditional Name: [2-(4-chloro-2-fluoro-3-methyl-phenoxy)-4-mesyl-benzyl]-methyl-amine Formula: C16H17ClFNO3S MolecularWeight: 357.827483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1F)OC2=C(C=CC(=C2)S(=O)(=O)C)CNC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1F)OC2=C(C=CC(=C2)S(=O)(=O)C)CNC)Cl

InChI

InChI=1S/C16H17ClFNO3S/c1-10-13(17)6-7-14(16(10)18)22-15-8-12(23(3,20)21)5-4-11(15)9-19-2/h4-8,19H,9H2,1-3H3