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2-(hydroxymethyl)-3-[3-nitro-4,5-bis(oxidanyl)phenyl]propanenitrile

2-(hydroxymethyl)-3-[3-nitro-4,5-bis(oxidanyl)phenyl]propanenitrile

Systemtic Name:2-(hydroxymethyl)-3-[3-nitro-4,5-bis(oxidanyl)phenyl]propanenitrile
Openeye Name:2-[(3,4-dihydroxy-5-nitro-phenyl)methyl]-3-hydroxy-propanenitrile
CAS Name:2-[(3,4-dihydroxy-5-nitrophenyl)methyl]-3-hydroxypropanenitrile
IUPAC Name:2-[(3,4-dihydroxy-5-nitrophenyl)methyl]-3-hydroxypropanenitrile
Traditional Name:2-(3,4-dihydroxy-5-nitro-benzyl)-3-hydroxy-propionitrile
Formula: C10H10N2O5
MolecularWeight: 238.1968
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C10H10N2O5/c11-4-7(5-13)1-6-2-8(12(16)17)10(15)9(14)3-6/h2-3,7,13-15H,1,5H2


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