(2-chloranyl-4-nitro-phenyl) 3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoate Openeye Name: (2-chloro-4-nitro-phenyl) 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoate CAS Name: 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoate Traditional Name: 3-(6-chloro-2-keto-1,3-benzoxazol-3-yl)propionic acid (2-chloro-4-nitro-phenyl) ester Formula: C16H10Cl2N2O6 MolecularWeight: 397.1664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OC(=O)CCN2C3=C(C=C(C=C3)Cl)OC2=O

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Cl)OC(=O)CCN2C3=C(C=C(C=C3)Cl)OC2=O

InChI

InChI=1S/C16H10Cl2N2O6/c17-9-1-3-12-14(7-9)26-16(22)19(12)6-5-15(21)25-13-4-2-10(20(23)24)8-11(13)18/h1-4,7-8H,5-6H2