Vitas-M small molecule compound
methyl 2-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzoate
Catalog ID
STL387318
SMILES COC(=O)c1ccccc1N1C(=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 C19H17NO4 MW 323.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO4/c1-24-19(23)11-4-2-3-5-14(11)20-17(21)15-9-6-7-10(13-8-12(9)13)16(15)18(20)22/h2-7,9-10,12-13,15-16H,8H2,1H3InChIKey
OBGUHHIBCDQXFQ-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=CC=C1N2C(=O)C3C4C=CC(C3C2=O)C5C4C5
InChI=1SC19H17NO4c12419(23)11423514(11)2017(21)1596710(13812(9)13)16(15)18(20)22h2791012131516H8H21H3
methyl2(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)benzoate
MFCD02306703
ZINC000239377516
ZINC000239377519
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