Vitas-M small molecule compound
benzyl 2,7,7-trimethyl-4-(naphthalen-1-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372358
SMILES O=C(C1=C(C)NC2=C(C1c1cccc3c1cccc3)C(=O)CC(C2)(C)C)OCc1ccccc1
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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 C30H29NO3 MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO3/c1-19-26(29(33)34-18-20-10-5-4-6-11-20)27(23-15-9-13-21-12-7-8-14-22(21)23)28-24(31-19)16-30(2,3)17-25(28)32/h4-15,27,31H,16-18H2,1-3H3InChIKey
ZBOITZHFSQSLEK-UHFFFAOYSA-NSynonyms
benzyl277trimethyl4(naphthalen1yl)5oxo145678hexahydroquinoline3carboxylate
benzyl277trimethyl4naphthalen1yl5oxo1468tetrahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=CC4=CC=CC=C43)C(=O)OCC5=CC=CC=C5
InChI=1SC30H29NO3c11926(29(33)341820105461120)27(23159132112781422(21)23)2824(3119)1630(23)1725(28)32h4152731H1618H213H3
MFCD00771016
ZINC000003098427
ZINC000003098428
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