2-[(2-chloranyl-5-nitro-phenyl)methylsulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[(2-chloranyl-5-nitro-phenyl)methylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[(2-chloro-5-nitro-phenyl)methylsulfanyl]-1,3-benzoxazole CAS Name: 2-[(2-chloro-5-nitrophenyl)methylthio]-1,3-benzoxazole IUPAC Name: 2-[(2-chloro-5-nitrophenyl)methylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[(2-chloro-5-nitro-benzyl)thio]-1,3-benzoxazole Formula: C14H9ClN2O3S MolecularWeight: 320.75086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H9ClN2O3S/c15-11-6-5-10(17(18)19)7-9(11)8-21-14-16-12-3-1-2-4-13(12)20-14/h1-7H,8H2