3-nitro-5-[(E)-oxidanyl(1H-quinolin-4-ylidene)methyl]cyclohexa-3,5-diene-1,2-dione hydrobromide

Systemtic Name: 3-nitro-5-[(E)-oxidanyl(1H-quinolin-4-ylidene)methyl]cyclohexa-3,5-diene-1,2-dione hydrobromide Openeye Name: 5-[(E)-hydroxy(1H-quinolin-4-ylidene)methyl]-3-nitro-1,2-benzoquinone hydrobromide CAS Name: 5-[(E)-hydroxy(1H-quinolin-4-ylidene)methyl]-3-nitrocyclohexa-3,5-diene-1,2-dione hydrobromide IUPAC Name: 5-[(E)-hydroxy(1H-quinolin-4-ylidene)methyl]-3-nitrocyclohexa-3,5-diene-1,2-dione hydrobromide Traditional Name: 5-[(E)-hydroxy(1H-quinolin-4-ylidene)methyl]-3-nitro-o-benzoquinone hydrobromide Formula: C16H11BrN2O5 MolecularWeight: 391.17294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C3=CC(=O)C(=O)C(=C3)[N+](=O)[O-])O)C=CN2.Br

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C(\C3=CC(=O)C(=O)C(=C3)[N+](=O)[O-])/O)/C=CN2.Br

InChI

InChI=1S/C16H10N2O5.BrH/c19-14-8-9(7-13(16(14)21)18(22)23)15(20)11-5-6-17-12-4-2-1-3-10(11)12;/h1-8,17,20H;1H/b15-11+;