N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methylphenoxy)butanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methylphenoxy)butanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methylphenoxy)butanoylamino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[4-(3-methylphenoxy)-1-oxobutyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(3-methylphenoxy)butanoylamino]benzamide Traditional Name: 2-[4-(3-methylphenoxy)butanoylamino]-N-piperonyl-benzamide Formula: C26H26N2O5 MolecularWeight: 446.49504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H26N2O5/c1-18-6-4-7-20(14-18)31-13-5-10-25(29)28-22-9-3-2-8-21(22)26(30)27-16-19-11-12-23-24(15-19)33-17-32-23/h2-4,6-9,11-12,14-15H,5,10,13,16-17H2,1H3,(H,27,30)(H,28,29)