ditert-butyl 2-(4,6-diazido-1,3,5-triazin-2-yl)-2-nitro-propanedioate

Systemtic Name: ditert-butyl 2-(4,6-diazido-1,3,5-triazin-2-yl)-2-nitro-propanedioate Openeye Name: ditert-butyl 2-(4,6-diazido-1,3,5-triazin-2-yl)-2-nitro-propanedioate CAS Name: 2-(4,6-diazido-1,3,5-triazin-2-yl)-2-nitropropanedioic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-(4,6-diazido-1,3,5-triazin-2-yl)-2-nitropropanedioate Traditional Name: 2-(4,6-diazido-s-triazin-2-yl)-2-nitro-malonic acid ditert-butyl ester Formula: C14H18N10O6 MolecularWeight: 422.35612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C1=NC(=NC(=N1)N=[N+]=[N-])N=[N+]=[N-])(C(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C(C1=NC(=NC(=N1)N=[N+]=[N-])N=[N+]=[N-])(C(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H18N10O6/c1-12(2,3)29-8(25)14(24(27)28,9(26)30-13(4,5)6)7-17-10(20-22-15)19-11(18-7)21-23-16/h1-6H3