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

Systemtic Name: N-[6-[2,3-bis(oxidanyl)propylamino]-5-chloranyl-3-nitro-pyrazin-2-yl]propanamide Openeye Name: N-[5-chloro-6-(2,3-dihydroxypropylamino)-3-nitro-pyrazin-2-yl]propanamide CAS Name: N-[5-chloro-6-(2,3-dihydroxypropylamino)-3-nitro-2-pyrazinyl]propanamide IUPAC Name: N-[5-chloro-6-(2,3-dihydroxypropylamino)-3-nitropyrazin-2-yl]propanamide Traditional Name: N-[5-chloro-6-(glycerylamino)-3-nitro-pyrazin-2-yl]propionamide Formula: C10H14ClN5O5 MolecularWeight: 319.70166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14ClN5O5/c1-2-6(19)13-9-10(16(20)21)14-7(11)8(15-9)12-3-5(18)4-17/h5,17-18H,2-4H2,1H3,(H2,12,13,15,19)