4-[3-(5-nitro-2-phenylmethoxy-phenyl)propyl]benzoate

Systemtic Name: 4-[3-(5-nitro-2-phenylmethoxy-phenyl)propyl]benzoate Openeye Name: 4-[3-(2-benzyloxy-5-nitro-phenyl)propyl]benzoate CAS Name: 4-[3-(5-nitro-2-phenylmethoxyphenyl)propyl]benzoate IUPAC Name: 4-[3-(5-nitro-2-phenylmethoxyphenyl)propyl]benzoate Traditional Name: 4-[3-(2-benzoxy-5-nitro-phenyl)propyl]benzoate Formula: C23H20NO5- MolecularWeight: 390.4086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])CCCC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)[N+](=O)[O-])CCCC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C23H21NO5/c25-23(26)19-11-9-17(10-12-19)7-4-8-20-15-21(24(27)28)13-14-22(20)29-16-18-5-2-1-3-6-18/h1-3,5-6,9-15H,4,7-8,16H2,(H,25,26)/p-1