tert-butyl 3-(3-nitrophenyl)benzoate

Systemtic Name: tert-butyl 3-(3-nitrophenyl)benzoate Openeye Name: tert-butyl 3-(3-nitrophenyl)benzoate CAS Name: 3-(3-nitrophenyl)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3-nitrophenyl)benzoate Traditional Name: 3-(3-nitrophenyl)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=CC=CC(=C1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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