Vitas-M small molecule compound
naphthalen-1-yl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate
Catalog ID
STK387178
SMILES O=C1N(c2cccc(c2)C(=O)Oc2cccc3c2cccc3)C(=O)C2C1C1C=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 C28H21NO4 MW 435.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21NO4/c30-26-24-19-11-12-20(22-14-21(19)22)25(24)27(31)29(26)17-8-3-7-16(13-17)28(32)33-23-10-4-6-15-5-1-2-9-18(15)23/h1-13,19-22,24-25H,14H2InChIKey
ADCXVHABALUTMP-UHFFFAOYSA-NSynonyms
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)C5=CC=CC(=C5)C(=O)OC6=CC=CC7=CC=CC=C76
InChI=1SC28H21NO4c30262419111220(221421(19)22)25(24)27(31)29(26)1783716(1317)28(32)3323104615512918(15)23h11319222425H14H2
MFCD02314657
naphthalen1yl3(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)benzoate
ZINC000238997270
ZINC000238997279
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