Vitas-M small molecule compound
2-methylpropyl (2S,6S)-2,4-dimethyl-3,6-dihydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxylate
Catalog ID
STK407701
SMILES CC(COC(=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 C18H23NO3 MW 301.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO3/c1-11(2)10-21-17(20)16-12(3)19-18(4)9-14(16)13-7-5-6-8-15(13)22-18/h5-8,11,14,19H,9-10H2,1-4H3/t14-,18-/m0/s1InChIKey
BVVLEUXAZGKRGQ-KSSFIOAISA-NSynonyms
2methylpropyl(2S6S)24dimethyl36dihydro2H26methano13benzoxazocine5carboxylate
CC(COC(=O)C1=C(C)N(C@@)2(C(C@H)1c1ccccc1O2)C)C
CC1=C(C2CC(N1)(OC3=CC=CC=C23)C)C(=O)OCC(C)C
InChI=1SC18H23NO3c111(2)102117(20)1612(3)1918(4)914(16)13756815(13)2218h58111419H910H214H3t1418m0s1
MFCD13368855
ZINC000020375170
ZINC20375170
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