Vitas-M small molecule compound
methyl 2-methyl-3-(2-methylphenyl)-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-8-carboxylate
Catalog ID
STL192613
SMILES COC(=O)c1ccc2c(c1)C1NC(=O)N(C(O2)(C1)C)c1ccccc1C
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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 C20H20N2O4 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O4/c1-12-6-4-5-7-16(12)22-19(24)21-15-11-20(22,2)26-17-9-8-13(10-14(15)17)18(23)25-3/h4-10,15H,11H2,1-3H3,(H,21,24)InChIKey
SBQNCLFTPGVBEI-UHFFFAOYSA-NSynonyms
899742-96-2899742962
CC1=CC=CC=C1N2C(=O)NC3CC2(OC4=C3C=C(C=C4)C(=O)OC)C
InChI=1SC20H20N2O4c112645716(12)2219(24)21151120(222)26179813(1014(15)17)18(23)253h41015H11H213H3(H2124)
methyl2methyl3(2methylphenyl)4oxo3456tetrahydro2H26methano135benzoxadiazocine8carboxylate
MFCD07650966
ZINC000004852840
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