Vitas-M small molecule compound
butan-2-yl 7-(4-chlorophenyl)-4-(2-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK377096
SMILES CCC(OC(=O)C1=C(C)NC2=C(C1c1ccccc1OC)C(=O)CC(C2)c1ccc(cc1)Cl)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 C28H30ClNO4 MW 480.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30ClNO4/c1-5-16(2)34-28(32)25-17(3)30-22-14-19(18-10-12-20(29)13-11-18)15-23(31)27(22)26(25)21-8-6-7-9-24(21)33-4/h6-13,16,19,26,30H,5,14-15H2,1-4H3InChIKey
DJLBAKDCUUWTDK-UHFFFAOYSA-NSynonyms
butan2yl7(4chlorophenyl)4(2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
butan2yl7(4chlorophenyl)4(2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CCC(C)OC(=O)C1=C(NC2=C(C1C3=CC=CC=C3OC)C(=O)CC(C2)C4=CC=C(C=C4)Cl)C
InChI=1SC28H30ClNO4c1516(2)3428(32)2517(3)30221419(18101220(29)131118)1523(31)27(22)26(25)21867924(21)334h61316192630H51415H214H3
MFCD01445747
ZINC000019770328
ZINC000036047497
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