[4-[[2-(3-bromophenyl)carbonylhydrazinyl]methylidene]-6-methyl-5-oxidanylidene-pyridin-3-yl]methyl dihydrogen phosphate

Systemtic Name: [4-[[2-(3-bromophenyl)carbonylhydrazinyl]methylidene]-6-methyl-5-oxidanylidene-pyridin-3-yl]methyl dihydrogen phosphate Openeye Name: [4-[[2-(3-bromobenzoyl)hydrazino]methylene]-6-methyl-5-oxo-3-pyridyl]methyl dihydrogen phosphate CAS Name: [4-[[[(3-bromophenyl)-oxomethyl]hydrazo]methylidene]-6-methyl-5-oxo-3-pyridinyl]methyl dihydrogen phosphate IUPAC Name: [4-[[2-(3-bromobenzoyl)hydrazinyl]methylidene]-6-methyl-5-oxopyridin-3-yl]methyl dihydrogen phosphate Traditional Name: [4-[[N'-(3-bromobenzoyl)hydrazino]methylene]-5-keto-6-methyl-3-pyridyl]methyl dihydrogen phosphate Formula: C15H15BrN3O6P MolecularWeight: 444.173861

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNNC(=O)C2=CC(=CC=C2)Br)C1=O)COP(=O)(O)O

Isomeric SMILES

CC1=NC=C(C(=CNNC(=O)C2=CC(=CC=C2)Br)C1=O)COP(=O)(O)O

InChI

InChI=1S/C15H15BrN3O6P/c1-9-14(20)13(11(6-17-9)8-25-26(22,23)24)7-18-19-15(21)10-3-2-4-12(16)5-10/h2-7,18H,8H2,1H3,(H,19,21)(H2,22,23,24)