2-[(3-nitrophenyl)-oxidanyl-methyl]naphthalene-1,4-dione

Systemtic Name: 2-[(3-nitrophenyl)-oxidanyl-methyl]naphthalene-1,4-dione Openeye Name: 2-[hydroxy-(3-nitrophenyl)methyl]naphthalene-1,4-dione CAS Name: 2-[hydroxy-(3-nitrophenyl)methyl]naphthalene-1,4-dione IUPAC Name: 2-[hydroxy-(3-nitrophenyl)methyl]naphthalene-1,4-dione Traditional Name: 2-[hydroxy-(3-nitrophenyl)methyl]-1,4-naphthoquinone Formula: C17H11NO5 MolecularWeight: 309.27294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C=C(C2=O)C(C3=CC(=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C=C(C2=O)C(C3=CC(=CC=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H11NO5/c19-15-9-14(17(21)13-7-2-1-6-12(13)15)16(20)10-4-3-5-11(8-10)18(22)23/h1-9,16,20H