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

Systemtic Name: 1-[2-[2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethyl]phenyl]-3-[2-(4-nitrophenyl)ethyl]urea Openeye Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-3-[2-(4-nitrophenyl)ethyl]urea CAS Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-3-[2-(4-nitrophenyl)ethyl]urea IUPAC Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxyphenyl)ethyl]phenyl]-3-[2-(4-nitrophenyl)ethyl]urea Traditional Name: 1-[2-[2-(3,5-ditert-butyl-4-hydroxy-phenyl)ethyl]phenyl]-3-[2-(4-nitrophenyl)ethyl]urea Formula: C31H39N3O4 MolecularWeight: 517.65906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)NCCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC2=CC=CC=C2NC(=O)NCCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C31H39N3O4/c1-30(2,3)25-19-22(20-26(28(25)35)31(4,5)6)11-14-23-9-7-8-10-27(23)33-29(36)32-18-17-21-12-15-24(16-13-21)34(37)38/h7-10,12-13,15-16,19-20,35H,11,14,17-18H2,1-6H3,(H2,32,33,36)