N-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)sulfonylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)sulfonylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)sulfonylamino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3-nitrophenyl)sulfonylamino]benzamide Traditional Name: 4-[(3-nitrophenyl)sulfonylamino]-N-piperonyl-benzamide Formula: C21H17N3O7S MolecularWeight: 455.44058

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O7S/c25-21(22-12-14-4-9-19-20(10-14)31-13-30-19)15-5-7-16(8-6-15)23-32(28,29)18-3-1-2-17(11-18)24(26)27/h1-11,23H,12-13H2,(H,22,25)