N-[6-[2,3-bis(oxidanyl)propylamino]-5-chloranyl-3-nitro-pyrazin-2-yl]butanamide

Systemtic Name: N-[6-[2,3-bis(oxidanyl)propylamino]-5-chloranyl-3-nitro-pyrazin-2-yl]butanamide Openeye Name: N-[5-chloro-6-(2,3-dihydroxypropylamino)-3-nitro-pyrazin-2-yl]butanamide CAS Name: N-[5-chloro-6-(2,3-dihydroxypropylamino)-3-nitro-2-pyrazinyl]butanamide IUPAC Name: N-[5-chloro-6-(2,3-dihydroxypropylamino)-3-nitropyrazin-2-yl]butanamide Traditional Name: N-[5-chloro-6-(glycerylamino)-3-nitro-pyrazin-2-yl]butyramide Formula: C11H16ClN5O5 MolecularWeight: 333.72824

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(N=C(C(=N1)NCC(CO)O)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=C(N=C(C(=N1)NCC(CO)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H16ClN5O5/c1-2-3-7(20)14-10-11(17(21)22)15-8(12)9(16-10)13-4-6(19)5-18/h6,18-19H,2-5H2,1H3,(H2,13,14,16,20)