Vitas-M small molecule compound
propan-2-yl (2S,6S)-2,4-dimethyl-3,6-dihydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxylate
Catalog ID
STK407705
SMILES CC(OC(=O)C1=C(C)N[C@@]2(C[C@H]1c1ccccc1O2)C)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 C17H21NO3 MW 287.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO3/c1-10(2)20-16(19)15-11(3)18-17(4)9-13(15)12-7-5-6-8-14(12)21-17/h5-8,10,13,18H,9H2,1-4H3/t13-,17-/m0/s1InChIKey
PDIZOUKWAWOXPK-GUYCJALGSA-NSynonyms
CC(OC(=O)C1=C(C)N(C@@)2(C(C@H)1c1ccccc1O2)C)C
CC1=C(C2CC(N1)(OC3=CC=CC=C23)C)C(=O)OC(C)C
InChI=1SC17H21NO3c110(2)2016(19)1511(3)1817(4)913(15)12756814(12)2117h58101318H9H214H3t1317m0s1
MFCD13368859
propan2yl(2S6S)24dimethyl36dihydro2H26methano13benzoxazocine5carboxylate
ZINC000020375183
ZINC20375183
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