N-[4-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]furan-2-carboxamide Openeye Name: N-[4-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]furan-2-carboxamide CAS Name: N-[4-[[[3-(1,3-benzodioxol-5-yl)-1-oxopropyl]amino]methyl]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]furan-2-carboxamide Traditional Name: N-[4-[[3-(1,3-benzodioxol-5-yl)propanoylamino]methyl]phenyl]-2-furamide Formula: C22H20N2O5 MolecularWeight: 392.4046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCC(=O)NCC3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCC(=O)NCC3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H20N2O5/c25-21(10-6-15-5-9-18-20(12-15)29-14-28-18)23-13-16-3-7-17(8-4-16)24-22(26)19-2-1-11-27-19/h1-5,7-9,11-12H,6,10,13-14H2,(H,23,25)(H,24,26)