N-[4-(dimethylamino)-3-(phenethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(dimethylamino)-3-(phenethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(dimethylamino)-3-(phenethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(dimethylamino)-3-[oxo-(phenethylamino)methyl]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(dimethylamino)-3-(phenethylcarbamoyl)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(dimethylamino)-3-(phenethylcarbamoyl)phenyl]-piperonylamide Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O4/c1-28(2)21-10-9-19(27-24(29)18-8-11-22-23(14-18)32-16-31-22)15-20(21)25(30)26-13-12-17-6-4-3-5-7-17/h3-11,14-15H,12-13,16H2,1-2H3,(H,26,30)(H,27,29)