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

Systemtic Name: 2-[(2-nitrophenyl)methylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[(2-nitrophenyl)methylsulfanyl]-1,3-benzoxazole CAS Name: 2-[(2-nitrophenyl)methylthio]-1,3-benzoxazole IUPAC Name: 2-[(2-nitrophenyl)methylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[(2-nitrobenzyl)thio]-1,3-benzoxazole Formula: C14H10N2O3S MolecularWeight: 286.3058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3O2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3O2)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O3S/c17-16(18)12-7-3-1-5-10(12)9-20-14-15-11-6-2-4-8-13(11)19-14/h1-8H,9H2