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

Systemtic Name: 5-[bis(azanyl)methylideneamino]-N-(4-methyl-1-oxidanylidene-pentan-2-yl)-2-nitramido-pentanamide Openeye Name: N-(1-formyl-3-methyl-butyl)-5-guanidino-2-nitramido-pentanamide CAS Name: 5-(diaminomethylideneamino)-N-(4-methyl-1-oxopentan-2-yl)-2-nitramidopentanamide IUPAC Name: 5-(diaminomethylideneamino)-N-(4-methyl-1-oxopentan-2-yl)-2-nitramidopentanamide Traditional Name: N-(1-formyl-3-methyl-butyl)-5-guanidino-2-nitramido-valeramide Formula: C12H24N6O4 MolecularWeight: 316.35676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H24N6O4/c1-8(2)6-9(7-19)16-11(20)10(17-18(21)22)4-3-5-15-12(13)14/h7-10,17H,3-6H2,1-2H3,(H,16,20)(H4,13,14,15)