sodium ethyl 4-[nitroso(oxidanidyl)amino]-1,4-diazepane-1-carboxylate

Systemtic Name: sodium ethyl 4-[nitroso(oxidanidyl)amino]-1,4-diazepane-1-carboxylate Openeye Name: sodium ethyl 4-[nitroso(oxido)amino]-1,4-diazepane-1-carboxylate CAS Name: sodium 4-[nitroso(oxido)amino]-1,4-diazepane-1-carboxylic acid ethyl ester IUPAC Name: sodium ethyl 4-[nitroso(oxido)amino]-1,4-diazepane-1-carboxylate Traditional Name: sodium 4-[nitroso(oxido)amino]-1,4-diazepane-1-carboxylic acid ethyl ester Formula: C8H15N4NaO4 MolecularWeight: 254.21887

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCN(CC1)N(N=O)[O-].[Na+]

Isomeric SMILES

CCOC(=O)N1CCCN(CC1)N(N=O)[O-].[Na+]

InChI

InChI=1S/C8H15N4O4.Na/c1-2-16-8(13)10-4-3-5-11(7-6-10)12(15)9-14;/h2-7H2,1H3;/q-1;+1