Vitas-M small molecule compound

methyl 8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxylate

Catalog ID
STK771448
SMILES COC(=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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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 C13H16N2O3 MW 248.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O3/c1-18-13(17)14-6-9-5-10(8-14)11-3-2-4-12(16)15(11)7-9/h2-4,9-10H,5-8H2,1H3
InChIKey
XPJCPQOVGUMVLU-UHFFFAOYSA-N
Synonyms

(1R5R)methyl8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carboxylate
COC(=O)N1C(C@@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
COC(=O)N1CC2CC(C1)C3=CC=CC(=O)N3C2
InChI=1SC13H16N2O3c11813(17)1469510(814)1132412(16)15(11)79h24910H58H21H3
methyl8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxylate
MFCD03764773
ZINC000000265605

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Available files

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