tert-butyl 2-bromanyl-4-(4-nitrophenyl)butanoate

Systemtic Name: tert-butyl 2-bromanyl-4-(4-nitrophenyl)butanoate Openeye Name: tert-butyl 2-bromo-4-(4-nitrophenyl)butanoate CAS Name: 2-bromo-4-(4-nitrophenyl)butanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-bromo-4-(4-nitrophenyl)butanoate Traditional Name: 2-bromo-4-(4-nitrophenyl)butyric acid tert-butyl ester Formula: C14H18BrNO4 MolecularWeight: 344.20102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC1=CC=C(C=C1)[N+](=O)[O-])Br

Isomeric SMILES

CC(C)(C)OC(=O)C(CCC1=CC=C(C=C1)[N+](=O)[O-])Br

InChI

InChI=1S/C14H18BrNO4/c1-14(2,3)20-13(17)12(15)9-6-10-4-7-11(8-5-10)16(18)19/h4-5,7-8,12H,6,9H2,1-3H3