methyl 5-(4-nitrophenyl)-5-oxidanyl-3-phenylmethoxy-pentanoate

Systemtic Name: methyl 5-(4-nitrophenyl)-5-oxidanyl-3-phenylmethoxy-pentanoate Openeye Name: methyl 3-benzyloxy-5-hydroxy-5-(4-nitrophenyl)pentanoate CAS Name: 5-hydroxy-5-(4-nitrophenyl)-3-phenylmethoxypentanoic acid methyl ester IUPAC Name: methyl 5-hydroxy-5-(4-nitrophenyl)-3-phenylmethoxypentanoate Traditional Name: 3-benzoxy-5-hydroxy-5-(4-nitrophenyl)valeric acid methyl ester Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(C1=CC=C(C=C1)[N+](=O)[O-])O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(CC(C1=CC=C(C=C1)[N+](=O)[O-])O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H21NO6/c1-25-19(22)12-17(26-13-14-5-3-2-4-6-14)11-18(21)15-7-9-16(10-8-15)20(23)24/h2-10,17-18,21H,11-13H2,1H3