dimethyl 3-(2-azidoethanoyl)-4-(azidomethyl)-4-methoxy-heptanedioate

Systemtic Name: dimethyl 3-(2-azidoethanoyl)-4-(azidomethyl)-4-methoxy-heptanedioate Openeye Name: dimethyl 3-(2-azidoacetyl)-4-(azidomethyl)-4-methoxy-heptanedioate CAS Name: 4-(azidomethyl)-3-(2-azido-1-oxoethyl)-4-methoxyheptanedioic acid dimethyl ester IUPAC Name: dimethyl 3-(2-azidoacetyl)-4-(azidomethyl)-4-methoxyheptanedioate Traditional Name: 3-(2-azidoacetyl)-4-(azidomethyl)-4-methoxy-pimelic acid dimethyl ester Formula: C13H20N6O6 MolecularWeight: 356.3345

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CN=[N+]=[N-])(C(CC(=O)OC)C(=O)CN=[N+]=[N-])OC

Isomeric SMILES

COC(=O)CCC(CN=[N+]=[N-])(C(CC(=O)OC)C(=O)CN=[N+]=[N-])OC

InChI

InChI=1S/C13H20N6O6/c1-23-11(21)4-5-13(25-3,8-17-19-15)9(6-12(22)24-2)10(20)7-16-18-14/h9H,4-8H2,1-3H3