2-[2,3-bis(oxidanyl)propylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[2,3-bis(oxidanyl)propylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-(2,3-dihydroxypropylamino)-5-nitro-benzonitrile CAS Name: 2-(2,3-dihydroxypropylamino)-5-nitrobenzonitrile IUPAC Name: 2-(2,3-dihydroxypropylamino)-5-nitrobenzonitrile Traditional Name: 2-(glycerylamino)-5-nitro-benzonitrile Formula: C10H11N3O4 MolecularWeight: 237.21204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NCC(CO)O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C#N)NCC(CO)O

InChI

InChI=1S/C10H11N3O4/c11-4-7-3-8(13(16)17)1-2-10(7)12-5-9(15)6-14/h1-3,9,12,14-15H,5-6H2