N-[2-(3-bromophenyl)ethyl]-2-isocyano-N-methyl-ethanamide

Systemtic Name: N-[2-(3-bromophenyl)ethyl]-2-isocyano-N-methyl-ethanamide Openeye Name: N-[2-(3-bromophenyl)ethyl]-2-isocyano-N-methyl-acetamide CAS Name: N-[2-(3-bromophenyl)ethyl]-2-isocyano-N-methylacetamide IUPAC Name: N-[2-(3-bromophenyl)ethyl]-2-isocyano-N-methylacetamide Traditional Name: N-[2-(3-bromophenyl)ethyl]-2-isocyano-N-methyl-acetamide Formula: C12H13BrN2O MolecularWeight: 281.14842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13BrN2O/c1-14-9-12(16)15(2)7-6-10-4-3-5-11(13)8-10/h3-5,8H,6-7,9H2,2H3