N-[[3-[(phenethylcarbamoylamino)methyl]phenyl]methyl]-1,3-benzodioxole-5-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC3=CC(=CC=C3)CNC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC3=CC(=CC=C3)CNC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H25N3O4/c29-24(21-9-10-22-23(14-21)32-17-31-22)27-15-19-7-4-8-20(13-19)16-28-25(30)26-12-11-18-5-2-1-3-6-18/h1-10,13-14H,11-12,15-17H2,(H,27,29)(H2,26,28,30)