6-chloranyl-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzoxazole

Systemtic Name: 6-chloranyl-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzoxazole Openeye Name: 6-chloro-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzoxazole CAS Name: 6-chloro-2-[(4-nitrophenyl)methylthio]-1,3-benzoxazole IUPAC Name: 6-chloro-2-[(4-nitrophenyl)methylsulfanyl]-1,3-benzoxazole Traditional Name: 6-chloro-2-[(4-nitrobenzyl)thio]-1,3-benzoxazole Formula: C14H9ClN2O3S MolecularWeight: 320.75086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC3=C(O2)C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC3=C(O2)C=C(C=C3)Cl)[N+](=O)[O-]

InChI

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