tert-butyl 4-nitro-2-phenyl-benzoate

Systemtic Name: tert-butyl 4-nitro-2-phenyl-benzoate Openeye Name: tert-butyl 4-nitro-2-phenyl-benzoate CAS Name: 4-nitro-2-phenylbenzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-nitro-2-phenylbenzoate Traditional Name: 4-nitro-2-phenyl-benzoic acid tert-butyl ester Formula: C17H17NO4 MolecularWeight: 299.32118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO4/c1-17(2,3)22-16(19)14-10-9-13(18(20)21)11-15(14)12-7-5-4-6-8-12/h4-11H,1-3H3