Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 7-(4-ethoxyphenyl)-2-methyl-4-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK407094
SMILES CCOc1ccc(cc1)C1CC2=C(C(=O)C1)C(C(=C(N2)C)C(=O)OCC1CCCO1)c1ccc(cc1)[N+](=O)[O-]
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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 C30H32N2O7 MW 532.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O7/c1-3-37-23-12-8-19(9-13-23)21-15-25-29(26(33)16-21)28(20-6-10-22(11-7-20)32(35)36)27(18(2)31-25)30(34)39-17-24-5-4-14-38-24/h6-13,21,24,28,31H,3-5,14-17H2,1-2H3InChIKey
CXMQPDCTRXYJQU-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)C2CC3=C(C(C(=C(N3)C)C(=O)OCC4CCCO4)C5=CC=C(C=C5)(N+)(=O)(O))C(=O)C2
CCOc1ccc(cc1)C1CC2=C(C(=O)C1)C(C(=C(N2)C)C(=O)OCC1CCCO1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC30H32N2O7c13372312819(91323)21152529(26(33)1621)28(2061022(11720)32(35)36)27(18(2)3125)30(34)39172454143824h61321242831H351417H212H3
MFCD06628560
oxolan2ylmethyl7(4ethoxyphenyl)2methyl4(4nitrophenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
tetrahydrofuran2ylmethyl7(4ethoxyphenyl)2methyl4(4nitrophenyl)5oxo145678hexahydroquinoline3carboxylate
ZINC000059626425
ZINC000239287523
Check stock
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Check stock on Vitas-MAvailable files
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