tert-butyl N-[(4-bromophenyl)-cyano-methyl]carbamate

Systemtic Name: tert-butyl N-[(4-bromophenyl)-cyano-methyl]carbamate Openeye Name: tert-butyl N-[(4-bromophenyl)-cyano-methyl]carbamate CAS Name: N-[(4-bromophenyl)-cyanomethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4-bromophenyl)-cyanomethyl]carbamate Traditional Name: N-[(4-bromophenyl)-cyano-methyl]carbamic acid tert-butyl ester Formula: C13H15BrN2O2 MolecularWeight: 311.1744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrN2O2/c1-13(2,3)18-12(17)16-11(8-15)9-4-6-10(14)7-5-9/h4-7,11H,1-3H3,(H,16,17)