N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-4-[(4-methylphenyl)sulfonylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-4-[(4-methylphenyl)sulfonylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-4-(p-tolylsulfonylamino)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-4-[(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-4-[(4-methylphenyl)sulfonylamino]benzamide Traditional Name: 2-chloro-N-piperonyl-4-(tosylamino)benzamide Formula: C22H19ClN2O5S MolecularWeight: 458.91466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C22H19ClN2O5S/c1-14-2-6-17(7-3-14)31(27,28)25-16-5-8-18(19(23)11-16)22(26)24-12-15-4-9-20-21(10-15)30-13-29-20/h2-11,25H,12-13H2,1H3,(H,24,26)