Vitas-M small molecule compound

propyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(2-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK003154
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1C)C(=O)CC(C2)c1ccc(c(c1)OC)OC

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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 C29H33NO5 MW 475.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO5/c1-6-13-35-29(32)26-18(3)30-22-14-20(19-11-12-24(33-4)25(16-19)34-5)15-23(31)28(22)27(26)21-10-8-7-9-17(21)2/h7-12,16,20,27,30H,6,13-15H2,1-5H3
InChIKey
NCKROOSKKDDKQJ-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1C)C(=O)CC(C2)c1ccc(c(c1)OC)OC
CCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3C)C(=O)CC(C2)C4=CC(=C(C=C4)OC)OC)C
InChI=1SC29H33NO5c16133529(32)2618(3)30221420(19111224(334)25(1619)345)1523(31)28(22)27(26)211087917(21)2h71216202730H61315H215H3
MFCD02224304
propyl7(34dimethoxyphenyl)2methyl4(2methylphenyl)5oxo145678hexahydroquinoline3carboxylate
propyl7(34dimethoxyphenyl)2methyl4(2methylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
STK003154
ZINC000002772008
ZINC000002772011

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Available files

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