2-[2-(3-azanylpropylamino)-5-nitro-phenyl]sulfonylethanol

Systemtic Name: 2-[2-(3-azanylpropylamino)-5-nitro-phenyl]sulfonylethanol Openeye Name: 2-[2-(3-aminopropylamino)-5-nitro-phenyl]sulfonylethanol CAS Name: 2-[2-(3-aminopropylamino)-5-nitrophenyl]sulfonylethanol IUPAC Name: 2-[2-(3-aminopropylamino)-5-nitrophenyl]sulfonylethanol Traditional Name: 2-[2-(3-aminopropylamino)-5-nitro-phenyl]sulfonylethanol Formula: C11H17N3O5S MolecularWeight: 303.33478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)CCO)NCCCN

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])S(=O)(=O)CCO)NCCCN

InChI

InChI=1S/C11H17N3O5S/c12-4-1-5-13-10-3-2-9(14(16)17)8-11(10)20(18,19)7-6-15/h2-3,8,13,15H,1,4-7,12H2