tert-butyl 4-(4-bromophenyl)-2-cyano-butanoate

Systemtic Name: tert-butyl 4-(4-bromophenyl)-2-cyano-butanoate Openeye Name: tert-butyl 4-(4-bromophenyl)-2-cyano-butanoate CAS Name: 4-(4-bromophenyl)-2-cyanobutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-bromophenyl)-2-cyanobutanoate Traditional Name: 4-(4-bromophenyl)-2-cyano-butyric acid tert-butyl ester Formula: C15H18BrNO2 MolecularWeight: 324.21292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC1=CC=C(C=C1)Br)C#N

Isomeric SMILES

CC(C)(C)OC(=O)C(CCC1=CC=C(C=C1)Br)C#N

InChI

InChI=1S/C15H18BrNO2/c1-15(2,3)19-14(18)12(10-17)7-4-11-5-8-13(16)9-6-11/h5-6,8-9,12H,4,7H2,1-3H3