(phenylmethyl) 4-nitrosopiperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-nitrosopiperazine-1-carboxylate Openeye Name: benzyl 4-nitrosopiperazine-1-carboxylate CAS Name: 4-nitroso-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-nitrosopiperazine-1-carboxylate Traditional Name: 4-nitrosopiperazine-1-carboxylic acid benzyl ester Formula: C12H15N3O3 MolecularWeight: 249.2658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)OCC2=CC=CC=C2)N=O

Isomeric SMILES

C1CN(CCN1C(=O)OCC2=CC=CC=C2)N=O

InChI

InChI=1S/C12H15N3O3/c16-12(14-6-8-15(13-17)9-7-14)18-10-11-4-2-1-3-5-11/h1-5H,6-10H2