N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,5-dimethyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,5-dimethyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,5-dimethyl-N-methylsulfonylanilino)acetamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-piperonyl-acetamide Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(CC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C)C

InChI

InChI=1S/C19H22N2O5S/c1-13-6-14(2)8-16(7-13)21(27(3,23)24)11-19(22)20-10-15-4-5-17-18(9-15)26-12-25-17/h4-9H,10-12H2,1-3H3,(H,20,22)