1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-1-methyl-urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-1-methyl-urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-1-methyl-urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-1-methylurea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-1-methylurea Traditional Name: 3-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-1-methyl-1-piperonyl-urea Formula: C32H40N2O4 MolecularWeight: 516.671

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)N(C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)N(C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C32H40N2O4/c1-31(2,3)24-16-21(17-25(29(24)35)32(4,5)6)12-14-23-10-8-9-11-26(23)33-30(36)34(7)19-22-13-15-27-28(18-22)38-20-37-27/h8-11,13,15-18,35H,12,14,19-20H2,1-7H3,(H,33,36)