Vitas-M small molecule compound

propyl 4-{[(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)acetyl]amino}benzoate

Catalog ID
STK275555
SMILES CCCOC(=O)c1ccc(cc1)NC(=O)CN1C(=O)C2C(C1=O)C1C=CC2C2C1C2

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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 C23H24N2O5 MW 408.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O5/c1-2-9-30-23(29)12-3-5-13(6-4-12)24-18(26)11-25-21(27)19-14-7-8-15(17-10-16(14)17)20(19)22(25)28/h3-8,14-17,19-20H,2,9-11H2,1H3,(H,24,26)
InChIKey
SXDAVWHCZUUBKB-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC23H24N2O5c1293023(29)123513(6412)2418(26)112521(27)19147815(171016(14)17)20(19)22(25)28h3814171920H2911H21H3(H2426)
MFCD03037712
propyl4(((13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)acetyl)amino)benzoate
ZINC000239212546
ZINC000239212549

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Available files

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