1-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-3-[(E)-heptadec-8-enyl]urea

Systemtic Name: 1-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-3-[(E)-heptadec-8-enyl]urea Openeye Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-3-[(E)-heptadec-8-enyl]urea CAS Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-3-[(E)-heptadec-8-enyl]urea IUPAC Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-3-[(E)-heptadec-8-enyl]urea Traditional Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-3-[(E)-heptadec-8-enyl]urea Formula: C40H64N2O2 MolecularWeight: 604.94836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCNC(=O)NC1=CC=CC=C1CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCNC(=O)NC1=CC=CC=C1CCC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C40H64N2O2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-29-41-38(44)42-36-26-23-22-25-33(36)28-27-32-30-34(39(2,3)4)37(43)35(31-32)40(5,6)7/h15-16,22-23,25-26,30-31,43H,8-14,17-21,24,27-29H2,1-7H3,(H2,41,42,44)/b16-15+