(4-nitrophenyl) 2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]ethanoate

Systemtic Name: (4-nitrophenyl) 2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]ethanoate Openeye Name: (4-nitrophenyl) 2-[(2-phenyloxazol-4-yl)methylsulfanyl]acetate CAS Name: 2-[(2-phenyl-4-oxazolyl)methylthio]acetic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]acetate Traditional Name: 2-[(2-phenyloxazol-4-yl)methylthio]acetic acid (4-nitrophenyl) ester Formula: C18H14N2O5S MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CO2)CSCC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CO2)CSCC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O5S/c21-17(25-16-8-6-15(7-9-16)20(22)23)12-26-11-14-10-24-18(19-14)13-4-2-1-3-5-13/h1-10H,11-12H2