5-chloranyl-2-(5-nitroquinolin-8-yl)sulfanyl-1,3-benzoxazole

Systemtic Name: 5-chloranyl-2-(5-nitroquinolin-8-yl)sulfanyl-1,3-benzoxazole Openeye Name: 5-chloro-2-[(5-nitro-8-quinolyl)sulfanyl]-1,3-benzoxazole CAS Name: 5-chloro-2-[(5-nitro-8-quinolinyl)thio]-1,3-benzoxazole IUPAC Name: 5-chloro-2-(5-nitroquinolin-8-yl)sulfanyl-1,3-benzoxazole Traditional Name: 5-chloro-2-[(5-nitro-8-quinolyl)thio]-1,3-benzoxazole Formula: C16H8ClN3O3S MolecularWeight: 357.77102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)SC3=NC4=C(O3)C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)SC3=NC4=C(O3)C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H8ClN3O3S/c17-9-3-5-13-11(8-9)19-16(23-13)24-14-6-4-12(20(21)22)10-2-1-7-18-15(10)14/h1-8H