4-[2,3-bis(oxidanyl)propylamino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[2,3-bis(oxidanyl)propylamino]-3-nitro-benzenecarbonitrile Openeye Name: 4-(2,3-dihydroxypropylamino)-3-nitro-benzonitrile CAS Name: 4-(2,3-dihydroxypropylamino)-3-nitrobenzonitrile IUPAC Name: 4-(2,3-dihydroxypropylamino)-3-nitrobenzonitrile Traditional Name: 4-(glycerylamino)-3-nitro-benzonitrile Formula: C10H11N3O4 MolecularWeight: 237.21204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCC(CO)O

Isomeric SMILES

C1=CC(=C(C=C1C#N)[N+](=O)[O-])NCC(CO)O

InChI

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