[4-(2-ethylsulfonylethoxy)-3-nitro-phenyl]methanamine

Systemtic Name: [4-(2-ethylsulfonylethoxy)-3-nitro-phenyl]methanamine Openeye Name: [4-(2-ethylsulfonylethoxy)-3-nitro-phenyl]methanamine CAS Name: [4-(2-ethylsulfonylethoxy)-3-nitrophenyl]methanamine IUPAC Name: [4-(2-ethylsulfonylethoxy)-3-nitrophenyl]methanamine Traditional Name: [4-(2-esylethoxy)-3-nitro-benzyl]amine Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CCOC1=C(C=C(C=C1)CN)[N+](=O)[O-]

Isomeric SMILES

CCS(=O)(=O)CCOC1=C(C=C(C=C1)CN)[N+](=O)[O-]

InChI

InChI=1S/C11H16N2O5S/c1-2-19(16,17)6-5-18-11-4-3-9(8-12)7-10(11)13(14)15/h3-4,7H,2,5-6,8,12H2,1H3