2-[(4-nitro-2-oxidanyl-3-phenylmethoxy-phenyl)methyl]pyran-4-one

Systemtic Name: 2-[(4-nitro-2-oxidanyl-3-phenylmethoxy-phenyl)methyl]pyran-4-one Openeye Name: 2-[(3-benzyloxy-2-hydroxy-4-nitro-phenyl)methyl]pyran-4-one CAS Name: 2-[(2-hydroxy-4-nitro-3-phenylmethoxyphenyl)methyl]-4-pyranone IUPAC Name: 2-[(2-hydroxy-4-nitro-3-phenylmethoxyphenyl)methyl]pyran-4-one Traditional Name: 2-(3-benzoxy-2-hydroxy-4-nitro-benzyl)pyran-4-one Formula: C19H15NO6 MolecularWeight: 353.3255

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=CC(=C2O)CC3=CC(=O)C=CO3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=CC(=C2O)CC3=CC(=O)C=CO3)[N+](=O)[O-]

InChI

InChI=1S/C19H15NO6/c21-15-8-9-25-16(11-15)10-14-6-7-17(20(23)24)19(18(14)22)26-12-13-4-2-1-3-5-13/h1-9,11,22H,10,12H2