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

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoate Openeye Name: (2-chloro-4-nitro-phenyl) 3-(2-oxo-1,3-benzoxazol-3-yl)propanoate CAS Name: 3-(2-oxo-1,3-benzoxazol-3-yl)propanoic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-(2-oxo-1,3-benzoxazol-3-yl)propanoate Traditional Name: 3-(2-keto-1,3-benzoxazol-3-yl)propionic acid (2-chloro-4-nitro-phenyl) ester Formula: C16H11ClN2O6 MolecularWeight: 362.72134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)O2)CCC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H11ClN2O6/c17-11-9-10(19(22)23)5-6-13(11)24-15(20)7-8-18-12-3-1-2-4-14(12)25-16(18)21/h1-6,9H,7-8H2