N-[5-chloranyl-3-nitro-6-[1,3,4-tris(oxidanyl)butan-2-ylamino]pyrazin-2-yl]ethanamide

Systemtic Name: N-[5-chloranyl-3-nitro-6-[1,3,4-tris(oxidanyl)butan-2-ylamino]pyrazin-2-yl]ethanamide Openeye Name: N-[5-chloro-6-[[2,3-dihydroxy-1-(hydroxymethyl)propyl]amino]-3-nitro-pyrazin-2-yl]acetamide CAS Name: N-[5-chloro-3-nitro-6-(1,3,4-trihydroxybutan-2-ylamino)-2-pyrazinyl]acetamide IUPAC Name: N-[5-chloro-3-nitro-6-(1,3,4-trihydroxybutan-2-ylamino)pyrazin-2-yl]acetamide Traditional Name: N-[5-chloro-6-[(2,3-dihydroxy-1-methylol-propyl)amino]-3-nitro-pyrazin-2-yl]acetamide Formula: C10H14ClN5O6 MolecularWeight: 335.70106

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(N=C(C(=N1)NC(CO)C(CO)O)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(N=C(C(=N1)NC(CO)C(CO)O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H14ClN5O6/c1-4(19)12-9-10(16(21)22)14-7(11)8(15-9)13-5(2-17)6(20)3-18/h5-6,17-18,20H,2-3H2,1H3,(H2,12,13,15,19)