Vitas-M small molecule compound
3-phenylpropyl 2-methyl-4-(2-nitrophenyl)-6-oxo-1,4,5,6-tetrahydropyridine-3-carboxylate
Catalog ID
STK025175
SMILES O=C1NC(=C(C(C1)c1ccccc1[N+](=O)[O-])C(=O)OCCCc1ccccc1)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 C22H22N2O5 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5/c1-15-21(22(26)29-13-7-10-16-8-3-2-4-9-16)18(14-20(25)23-15)17-11-5-6-12-19(17)24(27)28/h2-6,8-9,11-12,18H,7,10,13-14H2,1H3,(H,23,25)InChIKey
KULDOWIOIOZYNR-UHFFFAOYSA-NSynonyms
346725-14-2346725142
3phenylpropyl2methyl4(2nitrophenyl)6oxo1456tetrahydropyridine3carboxylate
3PHENYLPROPYL6METHYL4(2NITROPHENYL)2OXO34DIHYDRO1HPYRIDINE5CARBOXYLATE
CC1=C(C(CC(=O)N1)C2=CC=CC=C2(N+)(=O)(O))C(=O)OCCCC3=CC=CC=C3
InChI=1SC22H22N2O5c11521(22(26)2913710168324916)18(1420(25)2315)1711561219(17)24(27)28h2689111218H7101314H21H3(H2325)
MFCD01975566
O=C1NC(=C(C(C1)c1ccccc1(N+)(=O)(O))C(=O)OCCCc1ccccc1)C
STK025175
ZINC000004548930
ZINC000004548932
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