Vitas-M small molecule compound

3,4-dihydroisoquinolin-2(1H)-yl(3-methyl-2-nitrophenyl)methanone

Catalog ID
STK108330
SMILES O=C(c1cccc(c1[N+](=O)[O-])C)N1CCc2c(C1)cccc2

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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 C17H16N2O3 MW 296.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O3/c1-12-5-4-8-15(16(12)19(21)22)17(20)18-10-9-13-6-2-3-7-14(13)11-18/h2-8H,9-11H2,1H3
InChIKey
VLXJGBPUASSWDX-UHFFFAOYSA-N
Synonyms
600128-08-3
34DIHYDRO1HISOQUINOLIN2YL(3METHYL2NITROPHENYL)METHANONE
34DIHYDROISOQUINOLIN2(1H)YL(3METHYL2NITROPHENYL)METHANONE
600128083
CC1=CC=CC(=C1(N+)(=O)(O))C(=O)N2CCC3=CC=CC=C3C2
InChI=1SC17H16N2O3c11254815(16(12)19(21)22)17(20)1810913623714(13)1118h28H911H21H3
MFCD03639422
O=C(c1cccc(c1(N+)(=O)(O))C)N1CCc2c(C1)cccc2
ZINC000000464267
ZINC00464267
ZINC464267

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Available files

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