Vitas-M small molecule compound

heptyl 2-(3-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK247346
SMILES CCCCCCCOC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc(c1)C

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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 C23H25NO4 MW 379.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO4/c1-3-4-5-6-7-13-28-23(27)17-11-12-19-20(15-17)22(26)24(21(19)25)18-10-8-9-16(2)14-18/h8-12,14-15H,3-7,13H2,1-2H3
InChIKey
KEHUQQPMAJZGRF-UHFFFAOYSA-N
Synonyms

CCCCCCCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC(=C3)C
HEPTYL2(3METHYLPHENYL)13DIOXO23DIHYDRO1HISOINDOLE5CARBOXYLATE
HEPTYL2(3METHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
HEPTYL2(3METHYLPHENYL)13DIOXOISOINDOLINE5CARBOXYLATE
InChI=1SC23H25NO4c134567132823(27)1711121920(1517)22(26)24(21(19)25)18108916(2)1418h8121415H3713H212H3
MFCD01017567
ZINC000002062789
ZINC02062789
ZINC2062789

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Available files

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