3-(1,3-benzodioxol-5-yl)-N-(2-chloranyl-5-methylsulfonyl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(2-chloranyl-5-methylsulfonyl-phenyl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(2-chloro-5-methylsulfonyl-phenyl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(2-chloro-5-methylsulfonylphenyl)propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(2-chloro-5-methylsulfonylphenyl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(2-chloro-5-mesyl-phenyl)propionamide Formula: C17H16ClNO5S MolecularWeight: 381.83064

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16ClNO5S/c1-25(21,22)12-4-5-13(18)14(9-12)19-17(20)7-3-11-2-6-15-16(8-11)24-10-23-15/h2,4-6,8-9H,3,7,10H2,1H3,(H,19,20)