5-[bis(azanyl)methylideneamino]-N-[(1E)-1-hydroxyimino-4-methyl-pentan-2-yl]-2-nitramido-pentanamide

Systemtic Name: 5-[bis(azanyl)methylideneamino]-N-[(1E)-1-hydroxyimino-4-methyl-pentan-2-yl]-2-nitramido-pentanamide Openeye Name: 5-guanidino-N-[1-[(E)-hydroxyiminomethyl]-3-methyl-butyl]-2-nitramido-pentanamide CAS Name: 5-(diaminomethylideneamino)-N-[(1E)-1-hydroxyimino-4-methylpentan-2-yl]-2-nitramidopentanamide IUPAC Name: 5-(diaminomethylideneamino)-N-[(1E)-1-hydroxyimino-4-methylpentan-2-yl]-2-nitramidopentanamide Traditional Name: 5-guanidino-N-[1-[(E)-hydroximinomethyl]-3-methyl-butyl]-2-nitramido-valeramide Formula: C12H25N7O4 MolecularWeight: 331.3714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C=NO)NC(=O)C(CCCN=C(N)N)N[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(/C=N/O)NC(=O)C(CCCN=C(N)N)N[N+](=O)[O-]

InChI

InChI=1S/C12H25N7O4/c1-8(2)6-9(7-16-21)17-11(20)10(18-19(22)23)4-3-5-15-12(13)14/h7-10,18,21H,3-6H2,1-2H3,(H,17,20)(H4,13,14,15)/b16-7+