Vitas-M small molecule compound

1'-methyl-4'-(nitromethyl)-1',4'-dihydro-2,3'-biquinoline

Catalog ID
STK379041
SMILES [O-][N+](=O)CC1C(=CN(c2c1cccc2)C)c1ccc2c(n1)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 C20H17N3O2 MW 331.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O2/c1-22-12-17(19-11-10-14-6-2-4-8-18(14)21-19)16(13-23(24)25)15-7-3-5-9-20(15)22/h2-12,16H,13H2,1H3
InChIKey
OBLCUUGXPIDEBD-UHFFFAOYSA-N
Synonyms
354769-90-7
(O)(N+)(=O)CC1C(=CN(c2c1cccc2)C)c1ccc2c(n1)cccc2
1methyl4(nitromethyl)14dihydro23biquinoline
1METHYL4(NITROMETHYL)3QUINOLIN2YL4HQUINOLINE
2(1METHYL4(NITROMETHYL)314DIHYDROQUINOLYL)QUINOLINE
354769907
CN1C=C(C(C2=CC=CC=C21)C(N+)(=O)(O))C3=NC4=CC=CC=C4C=C3
InChI=1SC20H17N3O2c1221217(19111014624818(14)2119)16(1323(24)25)15735920(15)22h21216H13H21H3
MFCD01825381
ZINC000000173005
ZINC000000173009

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.