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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-nitrophenyl)sulfonylamino]propanamide Traditional Name: 3-(nosylamino)-N-piperonyl-propionamide Formula: C17H17N3O7S MolecularWeight: 407.39778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O7S/c21-17(18-10-12-1-6-15-16(9-12)27-11-26-15)7-8-19-28(24,25)14-4-2-13(3-5-14)20(22)23/h1-6,9,19H,7-8,10-11H2,(H,18,21)