N-[3-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[[3-(1,3-benzodioxol-5-yl)-1-oxopropyl]amino]methyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]cyclopropanecarboxamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O4/c24-20(9-5-14-4-8-18-19(11-14)27-13-26-18)22-12-15-2-1-3-17(10-15)23-21(25)16-6-7-16/h1-4,8,10-11,16H,5-7,9,12-13H2,(H,22,24)(H,23,25)