Vitas-M small molecule compound

2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid

Catalog ID
STL112306
SMILES COc1cccc(c1)n1cc(C(=O)O)c2c(c1=O)cccc2

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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 C17H13NO4 MW 295.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13NO4/c1-22-12-6-4-5-11(9-12)18-10-15(17(20)21)13-7-2-3-8-14(13)16(18)19/h2-10H,1H3,(H,20,21)
InChIKey
PUKONLZIGMRMOR-UHFFFAOYSA-N
Synonyms
439141-05-6
2(3methoxyphenyl)1oxo12dihydroisoquinoline4carboxylicacid
2(3METHOXYPHENYL)1OXOISOQUINOLINE4CARBOXYLICACID
439141056
COC1=CC=CC(=C1)N2C=C(C3=CC=CC=C3C2=O)C(=O)O
InChI=1SC17H13NO4c1221264511(912)181015(17(20)21)13723814(13)16(18)19h210H1H3(H2021)
MFCD03016051
ZINC000000109860
ZINC109860

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Available files

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