4-(2-methyl-4,6-dinitro-phenyl)thiomorpholine

Systemtic Name: 4-(2-methyl-4,6-dinitro-phenyl)thiomorpholine Openeye Name: 4-(2-methyl-4,6-dinitro-phenyl)thiomorpholine CAS Name: 4-(2-methyl-4,6-dinitrophenyl)thiomorpholine IUPAC Name: 4-(2-methyl-4,6-dinitrophenyl)thiomorpholine Traditional Name: 4-(2-methyl-4,6-dinitro-phenyl)thiomorpholine Formula: C11H13N3O4S MolecularWeight: 283.30362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N2CCSCC2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1N2CCSCC2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O4S/c1-8-6-9(13(15)16)7-10(14(17)18)11(8)12-2-4-19-5-3-12/h6-7H,2-5H2,1H3