2-azanyl-3-[bis(azanyl)methylideneamino]-6-nitro-2-oxidanyl-heptanoic acid

Systemtic Name: 2-azanyl-3-[bis(azanyl)methylideneamino]-6-nitro-2-oxidanyl-heptanoic acid Openeye Name: 2-amino-3-guanidino-2-hydroxy-6-nitro-heptanoic acid CAS Name: 2-amino-3-(diaminomethylideneamino)-2-hydroxy-6-nitroheptanoic acid IUPAC Name: 2-amino-3-(diaminomethylideneamino)-2-hydroxy-6-nitroheptanoic acid Traditional Name: 2-amino-3-guanidino-2-hydroxy-6-nitro-enanthic acid Formula: C8H17N5O5 MolecularWeight: 263.25108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H17N5O5/c1-4(13(17)18)2-3-5(12-7(9)10)8(11,16)6(14)15/h4-5,16H,2-3,11H2,1H3,(H,14,15)(H4,9,10,12)