Vitas-M small molecule compound
1-[(4-chloro-3-nitrophenyl)carbonyl]-2,2,4-trimethyl-1,2-dihydroquinolin-6-yl 2-nitrobenzoate
Catalog ID
STK060461
SMILES CC1=CC(C)(C)N(c2c1cc(cc2)OC(=O)c1ccccc1[N+](=O)[O-])C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C26H20ClN3O7 MW 521.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN3O7/c1-15-14-26(2,3)28(24(31)16-8-10-20(27)23(12-16)30(35)36)21-11-9-17(13-19(15)21)37-25(32)18-6-4-5-7-22(18)29(33)34/h4-14H,1-3H3InChIKey
ZSZOHMSKZVHTQF-UHFFFAOYSA-NSynonyms
374098-27-8(1(4CHLORO3NITROBENZOYL)224TRIMETHYLQUINOLIN6YL)2NITROBENZOATE
1((4CHLORO3NITROPHENYL)CARBONYL)224TRIMETHYL12DIHYDROQUINOLIN6YL2NITROBENZOATE
1((4CHLORO3NITROPHENYL)CARBONYL)224TRIMETHYL612DIHYDROQUINOLYL2NITROBENZOATE
1(4CHLORO3NITROBENZOYL)224TRIMETHYL12DIHYDROQUINOLIN6YL2NITROBENZOATE
374098278
CC1=CC(C)(C)N(c2c1cc(cc2)OC(=O)c1ccccc1(N+)(=O)(O))C(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
CC1=CC(N(C2=C1C=C(C=C2)OC(=O)C3=CC=CC=C3(N+)(=O)(O))C(=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))(C)C
InChI=1SC26H20ClN3O7c1151426(23)28(24(31)1681020(27)23(1216)30(35)36)2111917(1319(15)21)3725(32)18645722(18)29(33)34h414H13H3
MFCD01952790
STK060461
ZINC000002286053
ZINC2286053
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