4-bromanyl-N-methyl-3-nitro-N-(thiolan-3-yl)benzamide

Systemtic Name: 4-bromanyl-N-methyl-3-nitro-N-(thiolan-3-yl)benzamide Openeye Name: 4-bromo-N-methyl-3-nitro-N-tetrahydrothiophen-3-yl-benzamide CAS Name: 4-bromo-N-methyl-3-nitro-N-(3-thiolanyl)benzamide IUPAC Name: 4-bromo-N-methyl-3-nitro-N-(thiolan-3-yl)benzamide Traditional Name: 4-bromo-N-methyl-3-nitro-N-tetrahydrothiophen-3-yl-benzamide Formula: C12H13BrN2O3S MolecularWeight: 345.21222

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCSC1)C(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCSC1)C(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H13BrN2O3S/c1-14(9-4-5-19-7-9)12(16)8-2-3-10(13)11(6-8)15(17)18/h2-3,6,9H,4-5,7H2,1H3