2-[(4-methylphenyl)sulfonylmethyl]-5-nitro-furan

Systemtic Name: 2-[(4-methylphenyl)sulfonylmethyl]-5-nitro-furan Openeye Name: 2-nitro-5-(p-tolylsulfonylmethyl)furan CAS Name: 2-[(4-methylphenyl)sulfonylmethyl]-5-nitrofuran IUPAC Name: 2-[(4-methylphenyl)sulfonylmethyl]-5-nitrofuran Traditional Name: 2-nitro-5-(tosylmethyl)furan Formula: C12H11NO5S MolecularWeight: 281.28444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C12H11NO5S/c1-9-2-5-11(6-3-9)19(16,17)8-10-4-7-12(18-10)13(14)15/h2-7H,8H2,1H3