(1-oxidanylidene-1-phenyl-butan-2-yl) 4-(2-chloranyl-6-nitro-phenoxy)benzoate

Systemtic Name: (1-oxidanylidene-1-phenyl-butan-2-yl) 4-(2-chloranyl-6-nitro-phenoxy)benzoate Openeye Name: 1-benzoylpropyl 4-(2-chloro-6-nitro-phenoxy)benzoate CAS Name: 4-(2-chloro-6-nitrophenoxy)benzoic acid (1-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-1-phenylbutan-2-yl) 4-(2-chloro-6-nitrophenoxy)benzoate Traditional Name: 4-(2-chloro-6-nitro-phenoxy)benzoic acid 1-benzoylpropyl ester Formula: C23H18ClNO6 MolecularWeight: 439.84512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)OC3=C(C=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)OC3=C(C=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H18ClNO6/c1-2-20(21(26)15-7-4-3-5-8-15)31-23(27)16-11-13-17(14-12-16)30-22-18(24)9-6-10-19(22)25(28)29/h3-14,20H,2H2,1H3