4-tert-butyl-2-(4-nitrophenyl)carbonyl-benzoate

Systemtic Name: 4-tert-butyl-2-(4-nitrophenyl)carbonyl-benzoate Openeye Name: 4-tert-butyl-2-(4-nitrobenzoyl)benzoate CAS Name: 4-tert-butyl-2-[(4-nitrophenyl)-oxomethyl]benzoate IUPAC Name: 4-tert-butyl-2-(4-nitrobenzoyl)benzoate Traditional Name: 4-tert-butyl-2-(4-nitrobenzoyl)benzoate Formula: C18H16NO5- MolecularWeight: 326.32334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO5/c1-18(2,3)12-6-9-14(17(21)22)15(10-12)16(20)11-4-7-13(8-5-11)19(23)24/h4-10H,1-3H3,(H,21,22)/p-1