sodium (phenylmethyl) 4-[nitroso(oxidanidyl)amino]piperazine-1-carboxylate

Systemtic Name: sodium (phenylmethyl) 4-[nitroso(oxidanidyl)amino]piperazine-1-carboxylate Openeye Name: sodium benzyl 4-[nitroso(oxido)amino]piperazine-1-carboxylate CAS Name: sodium 4-[nitroso(oxido)amino]-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: sodium benzyl 4-[nitroso(oxido)amino]piperazine-1-carboxylate Traditional Name: sodium 4-[nitroso(oxido)amino]piperazine-1-carboxylic acid benzyl ester Formula: C12H15N4NaO4 MolecularWeight: 302.26167

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)OCC2=CC=CC=C2)N(N=O)[O-].[Na+]

Isomeric SMILES

C1CN(CCN1C(=O)OCC2=CC=CC=C2)N(N=O)[O-].[Na+]

InChI

InChI=1S/C12H15N4O4.Na/c17-12(20-10-11-4-2-1-3-5-11)14-6-8-15(9-7-14)16(19)13-18;/h1-5H,6-10H2;/q-1;+1