Vitas-M small molecule compound
methyl 8-chloro-2-methyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxylate
Catalog ID
STL134802
SMILES COC(=O)C1C(=O)NC2(CC1c1cc(Cl)ccc1O2)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 C14H14ClNO4 MW 295.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14ClNO4/c1-14-6-9(11(12(17)16-14)13(18)19-2)8-5-7(15)3-4-10(8)20-14/h3-5,9,11H,6H2,1-2H3,(H,16,17)InChIKey
BPGGFBIZPWGSCZ-UHFFFAOYSA-NSynonyms
353296-61-4353296614
CC12CC(C(C(=O)N1)C(=O)OC)C3=C(O2)C=CC(=C3)Cl
InChI=1SC14H14ClNO4c11469(11(12(17)1614)13(18)192)857(15)3410(8)2014h35911H6H212H3(H1617)
methyl8chloro2methyl4oxo3456tetrahydro2H26methano13benzoxazocine5carboxylate
MFCD01532494
ZINC000102922620
ZINC000242425574
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