tert-butyl 2-[4-(4-cyanophenyl)phenoxy]-5-nitro-benzoate

Systemtic Name: tert-butyl 2-[4-(4-cyanophenyl)phenoxy]-5-nitro-benzoate Openeye Name: tert-butyl 2-[4-(4-cyanophenyl)phenoxy]-5-nitro-benzoate CAS Name: 2-[4-(4-cyanophenyl)phenoxy]-5-nitrobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(4-cyanophenyl)phenoxy]-5-nitrobenzoate Traditional Name: 2-[4-(4-cyanophenyl)phenoxy]-5-nitro-benzoic acid tert-butyl ester Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H20N2O5/c1-24(2,3)31-23(27)21-14-19(26(28)29)10-13-22(21)30-20-11-8-18(9-12-20)17-6-4-16(15-25)5-7-17/h4-14H,1-3H3