(phenylmethyl) N-(3-bromanylpyrazin-1-ium-1-yl)carbamate

Systemtic Name: (phenylmethyl) N-(3-bromanylpyrazin-1-ium-1-yl)carbamate Openeye Name: benzyl N-(3-bromopyrazin-1-ium-1-yl)carbamate CAS Name: N-(3-bromo-1-pyrazin-1-iumyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(3-bromopyrazin-1-ium-1-yl)carbamate Traditional Name: N-(3-bromopyrazin-1-ium-1-yl)carbamic acid benzyl ester Formula: C12H11BrN3O2+ MolecularWeight: 309.13864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N[N+]2=CC(=NC=C2)Br

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[N+]2=CC(=NC=C2)Br

InChI

InChI=1S/C12H10BrN3O2/c13-11-8-16(7-6-14-11)15-12(17)18-9-10-4-2-1-3-5-10/h1-8H,9H2/p+1