tert-butyl N-[5-(3-tert-butyl-4-oxidanyl-phenoxy)-2-nitro-phenyl]-N-ethyl-carbamate

Systemtic Name: tert-butyl N-[5-(3-tert-butyl-4-oxidanyl-phenoxy)-2-nitro-phenyl]-N-ethyl-carbamate Openeye Name: tert-butyl N-[5-(3-tert-butyl-4-hydroxy-phenoxy)-2-nitro-phenyl]-N-ethyl-carbamate CAS Name: N-[5-(3-tert-butyl-4-hydroxyphenoxy)-2-nitrophenyl]-N-ethylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-(3-tert-butyl-4-hydroxyphenoxy)-2-nitrophenyl]-N-ethylcarbamate Traditional Name: N-[5-(3-tert-butyl-4-hydroxy-phenoxy)-2-nitro-phenyl]-N-ethyl-carbamic acid tert-butyl ester Formula: C23H30N2O6 MolecularWeight: 430.4941

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=CC(=C1)OC2=CC(=C(C=C2)O)C(C)(C)C)[N+](=O)[O-])C(=O)OC(C)(C)C

Isomeric SMILES

CCN(C1=C(C=CC(=C1)OC2=CC(=C(C=C2)O)C(C)(C)C)[N+](=O)[O-])C(=O)OC(C)(C)C

InChI

InChI=1S/C23H30N2O6/c1-8-24(21(27)31-23(5,6)7)19-14-16(9-11-18(19)25(28)29)30-15-10-12-20(26)17(13-15)22(2,3)4/h9-14,26H,8H2,1-7H3