Vitas-M small molecule compound

propyl 4-(4-oxo-3,4-dihydrophthalazin-1-yl)benzoate

Catalog ID
STK097650
SMILES CCCOC(=O)c1ccc(cc1)c1n[nH]c(=O)c2c1cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H16N2O3 MW 308.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O3/c1-2-11-23-18(22)13-9-7-12(8-10-13)16-14-5-3-4-6-15(14)17(21)20-19-16/h3-10H,2,11H2,1H3,(H,20,21)
InChIKey
BOEGFEDHJNTYIR-UHFFFAOYSA-N
Synonyms
332390-51-9
332390519
CCCOC(=O)C1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32
CCCOC(=O)c1ccc(cc1)c1n(nH)c(=O)c2c1cccc2
InChI=1SC18H16N2O3c12112318(22)139712(81013)1614534615(14)17(21)201916h310H211H21H3(H2021)
MFCD01946735
PROPYL4(4OXO34DIHYDROPHTHALAZIN1YL)BENZOATE
PROPYL4(4OXO3HPHTHALAZIN1YL)BENZOATE
STK097650
ZINC000002280101
ZINC02280101
ZINC2280101

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.