2-(4-chlorophenyl)-2-methyl-6-nitro-4H-1,3-benzoxathiine

Systemtic Name: 2-(4-chlorophenyl)-2-methyl-6-nitro-4H-1,3-benzoxathiine Openeye Name: 2-(4-chlorophenyl)-2-methyl-6-nitro-4H-1,3-benzoxathiine CAS Name: 2-(4-chlorophenyl)-2-methyl-6-nitro-4H-1,3-benzoxathiin IUPAC Name: 2-(4-chlorophenyl)-2-methyl-6-nitro-4H-1,3-benzoxathiine Traditional Name: 2-(4-chlorophenyl)-2-methyl-6-nitro-4H-1,3-benzoxathiin Formula: C15H12ClNO3S MolecularWeight: 321.77868

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(CS1)C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1(OC2=C(CS1)C=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClNO3S/c1-15(11-2-4-12(16)5-3-11)20-14-7-6-13(17(18)19)8-10(14)9-21-15/h2-8H,9H2,1H3