Vitas-M small molecule compound

N-(3-methoxyphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide

Catalog ID
STL198737
SMILES COc1cccc(c1)NC(=O)c1cc2C(=O)CCCc2[nH]c1=O

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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 C17H16N2O4 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4/c1-23-11-5-2-4-10(8-11)18-16(21)13-9-12-14(19-17(13)22)6-3-7-15(12)20/h2,4-5,8-9H,3,6-7H2,1H3,(H,18,21)(H,19,22)
InChIKey
BOCQASSWMFDJNL-UHFFFAOYSA-N
Synonyms

COC1=CC=CC(=C1)NC(=O)C2=CC3=C(CCCC3=O)NC2=O
COc1cccc(c1)NC(=O)c1cc2C(=O)CCCc2(nH)c1=O
InChI=1SC17H16N2O4c1231152410(811)1816(21)1391214(1917(13)22)63715(12)20h24589H367H21H3(H1821)(H1922)
MFCD20503348
N(3methoxyphenyl)25dioxo125678hexahydroquinoline3carboxamide
N(3methoxyphenyl)25dioxo1678tetrahydroquinoline3carboxamide
ZINC000029507690
ZINC29507690

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Available files

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