3-[4-(2-methylbutoxy)-3-nitro-phenyl]carbonyloxy-4-phenyl-benzoate

Systemtic Name: 3-[4-(2-methylbutoxy)-3-nitro-phenyl]carbonyloxy-4-phenyl-benzoate Openeye Name: 3-[4-(2-methylbutoxy)-3-nitro-benzoyl]oxy-4-phenyl-benzoate CAS Name: 3-[[4-(2-methylbutoxy)-3-nitrophenyl]-oxomethoxy]-4-phenylbenzoate IUPAC Name: 3-[4-(2-methylbutoxy)-3-nitrobenzoyl]oxy-4-phenylbenzoate Traditional Name: 3-[4-(2-methylbutoxy)-3-nitro-benzoyl]oxy-4-phenyl-benzoate Formula: C25H22NO7- MolecularWeight: 448.44468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC1=C(C=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(=O)[O-])C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C)COC1=C(C=C(C=C1)C(=O)OC2=C(C=CC(=C2)C(=O)[O-])C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H23NO7/c1-3-16(2)15-32-22-12-10-19(13-21(22)26(30)31)25(29)33-23-14-18(24(27)28)9-11-20(23)17-7-5-4-6-8-17/h4-14,16H,3,15H2,1-2H3,(H,27,28)/p-1