(4-cyclopropylcarbonyl-3-nitro-phenyl)methanesulfinic acid

Systemtic Name: (4-cyclopropylcarbonyl-3-nitro-phenyl)methanesulfinic acid Openeye Name: [4-(cyclopropanecarbonyl)-3-nitro-phenyl]methanesulfinic acid CAS Name: [4-[cyclopropyl(oxo)methyl]-3-nitrophenyl]methanesulfinic acid IUPAC Name: [4-(cyclopropanecarbonyl)-3-nitrophenyl]methanesulfinic acid Traditional Name: [4-(cyclopropanecarbonyl)-3-nitro-phenyl]methanesulfinic acid Formula: C11H11NO5S MolecularWeight: 269.27374

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C2=C(C=C(C=C2)CS(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)C2=C(C=C(C=C2)CS(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H11NO5S/c13-11(8-2-3-8)9-4-1-7(6-18(16)17)5-10(9)12(14)15/h1,4-5,8H,2-3,6H2,(H,16,17)