2-(2-azanyl-3-nitro-6-phenethyl-phenyl)sulfonylethanol

Systemtic Name: 2-(2-azanyl-3-nitro-6-phenethyl-phenyl)sulfonylethanol Openeye Name: 2-(2-amino-3-nitro-6-phenethyl-phenyl)sulfonylethanol CAS Name: 2-(2-amino-3-nitro-6-phenethylphenyl)sulfonylethanol IUPAC Name: 2-(2-amino-3-nitro-6-phenethylphenyl)sulfonylethanol Traditional Name: 2-(2-amino-3-nitro-6-phenethyl-phenyl)sulfonylethanol Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(C(=C(C=C2)[N+](=O)[O-])N)S(=O)(=O)CCO

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(C(=C(C=C2)[N+](=O)[O-])N)S(=O)(=O)CCO

InChI

InChI=1S/C16H18N2O5S/c17-15-14(18(20)21)9-8-13(16(15)24(22,23)11-10-19)7-6-12-4-2-1-3-5-12/h1-5,8-9,19H,6-7,10-11,17H2