2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-chloranyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-chloranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-chloro-4-methyl-phenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-chloro-4-methylphenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-(3-chloro-4-methylphenyl)acetamide Traditional Name: 2-[1,3-benzodioxol-5-yl(mesyl)amino]-N-(3-chloro-4-methyl-phenyl)acetamide Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C)Cl

InChI

InChI=1S/C17H17ClN2O5S/c1-11-3-4-12(7-14(11)18)19-17(21)9-20(26(2,22)23)13-5-6-15-16(8-13)25-10-24-15/h3-8H,9-10H2,1-2H3,(H,19,21)