3-(1,3-benzodioxol-5-ylmethyl)-1,1-diphenyl-urea

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,1-diphenyl-urea Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,1-diphenyl-urea CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,1-diphenylurea IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,1-diphenylurea Traditional Name: 1,1-diphenyl-3-piperonyl-urea Formula: C21H18N2O3 MolecularWeight: 346.37922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O3/c24-21(22-14-16-11-12-19-20(13-16)26-15-25-19)23(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-13H,14-15H2,(H,22,24)