2-[(4-nitrophenyl)-oxidanyl-methyl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-[(4-nitrophenyl)-oxidanyl-methyl]cyclohepta-2,4,6-trien-1-one Openeye Name: 2-[hydroxy-(4-nitrophenyl)methyl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-[hydroxy-(4-nitrophenyl)methyl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-[hydroxy-(4-nitrophenyl)methyl]cyclohepta-2,4,6-trien-1-one Traditional Name: 2-[hydroxy-(4-nitrophenyl)methyl]cyclohepta-2,4,6-trien-1-one Formula: C14H11NO4 MolecularWeight: 257.24144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO4/c16-13-5-3-1-2-4-12(13)14(17)10-6-8-11(9-7-10)15(18)19/h1-9,14,17H