1-[4-[3,5-bis[4-(octylcarbamoylamino)phenoxy]phenoxy]phenyl]-3-octyl-urea

Systemtic Name: 1-[4-[3,5-bis[4-(octylcarbamoylamino)phenoxy]phenoxy]phenyl]-3-octyl-urea Openeye Name: 1-[4-[3,5-bis[4-(octylcarbamoylamino)phenoxy]phenoxy]phenyl]-3-octyl-urea CAS Name: 1-[4-[3,5-bis[4-[[(octylamino)-oxomethyl]amino]phenoxy]phenoxy]phenyl]-3-octylurea IUPAC Name: 1-[4-[3,5-bis[4-(octylcarbamoylamino)phenoxy]phenoxy]phenyl]-3-octylurea Traditional Name: 1-[4-[3,5-bis[4-(octylcarbamoylamino)phenoxy]phenoxy]phenyl]-3-octyl-urea Formula: C51H72N6O6 MolecularWeight: 865.15398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)NC1=CC=C(C=C1)OC2=CC(=CC(=C2)OC3=CC=C(C=C3)NC(=O)NCCCCCCCC)OC4=CC=C(C=C4)NC(=O)NCCCCCCCC

Isomeric SMILES

CCCCCCCCNC(=O)NC1=CC=C(C=C1)OC2=CC(=CC(=C2)OC3=CC=C(C=C3)NC(=O)NCCCCCCCC)OC4=CC=C(C=C4)NC(=O)NCCCCCCCC

InChI

InChI=1S/C51H72N6O6/c1-4-7-10-13-16-19-34-52-49(58)55-40-22-28-43(29-23-40)61-46-37-47(62-44-30-24-41(25-31-44)56-50(59)53-35-20-17-14-11-8-5-2)39-48(38-46)63-45-32-26-42(27-33-45)57-51(60)54-36-21-18-15-12-9-6-3/h22-33,37-39H,4-21,34-36H2,1-3H3,(H2,52,55,58)(H2,53,56,59)(H2,54,57,60)