Vitas-M small molecule compound
2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 2-methyl-3-nitrobenzoate
Catalog ID
STK074063
SMILES CC1CC(C)(C)Nc2c1cc(cc2)OC(=O)c1cccc(c1C)[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 C20H22N2O4 MW 354.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4/c1-12-11-20(3,4)21-17-9-8-14(10-16(12)17)26-19(23)15-6-5-7-18(13(15)2)22(24)25/h5-10,12,21H,11H2,1-4H3InChIKey
GZHSKNPATISCSE-UHFFFAOYSA-NSynonyms
(224TRIMETHYL34DIHYDRO1HQUINOLIN6YL)2METHYL3NITROBENZOATE
224trimethyl1234tetrahydroquinolin6yl2methyl3nitrobenzoate
CC1CC(C)(C)Nc2c1cc(cc2)OC(=O)c1cccc(c1C)(N+)(=O)(O)
CC1CC(NC2=C1C=C(C=C2)OC(=O)C3=C(C(=CC=C3)(N+)(=O)(O))C)(C)C
InChI=1SC20H22N2O4c1121120(34)21179814(1016(12)17)2619(23)1565718(13(15)2)22(24)25h5101221H11H214H3
MFCD02817101
STK074063
ZINC000001181066
ZINC000001181067
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