Vitas-M small molecule compound

2-methoxy-4-[(E)-2-(8-methoxyquinolin-2-yl)ethenyl]-3-nitrophenyl acetate

Catalog ID
STK980316
SMILES COc1c(ccc(c1[N+](=O)[O-])/C=C/c1ccc2c(n1)c(OC)ccc2)OC(=O)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 C21H18N2O6 MW 394.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O6/c1-13(24)29-18-12-9-15(20(23(25)26)21(18)28-3)8-11-16-10-7-14-5-4-6-17(27-2)19(14)22-16/h4-12H,1-3H3/b11-8+
InChIKey
NPNIIPQOOKFRRG-DHZHZOJOSA-N
Synonyms

(2METHOXY4((E)2(8METHOXYQUINOLIN2YL)ETHENYL)3NITROPHENYL)ACETATE
2methoxy4((E)2(8methoxyquinolin2yl)ethenyl)3nitrophenylacetate
2METHOXY4(2(8METHOXY2QUINOLINYL)VINYL)3NITROPHENYLACETATE
CC(=O)OC1=C(C(=C(C=C1)C=CC2=NC3=C(C=CC=C3OC)C=C2)(N+)(=O)(O))OC
COc1c(ccc(c1(N+)(=O)(O))C=Cc1ccc2c(n1)c(OC)ccc2)OC(=O)C
InChI=1SC21H18N2O6c113(24)291812915(20(23(25)26)21(18)283)811161071454617(272)19(14)2216h412H13H3b118+
MFCD04216591
ZINC000004998382
ZINC04998382
ZINC4998382

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Available files

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