Vitas-M small molecule compound
methyl 4-(4,5-dimethoxy-2-nitrophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK373567
SMILES COC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1[N+](=O)[O-])OC)C(=O)CC(C2)c1ccccc1
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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 C26H26N2O7 MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O7/c1-14-23(26(30)35-4)24(17-12-21(33-2)22(34-3)13-19(17)28(31)32)25-18(27-14)10-16(11-20(25)29)15-8-6-5-7-9-15/h5-9,12-13,16,24,27H,10-11H2,1-4H3InChIKey
PIQNUXLQAYRRIR-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=C(C=C4(N+)(=O)(O))OC)OC)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1cc(OC)c(cc1(N+)(=O)(O))OC)C(=O)CC(C2)c1ccccc1
InChI=1SC26H26N2O7c11423(26(30)354)24(171221(332)22(343)1319(17)28(31)32)2518(2714)1016(1120(25)29)158657915h591213162427H1011H214H3
methyl4(45dimethoxy2nitrophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
methyl4(45dimethoxy2nitrophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
MFCD00785423
ZINC000019805285
ZINC000019805290
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