Vitas-M small molecule compound
N-butyl-3-nitro-N-[(2-oxo-1,2-dihydroquinolin-3-yl)methyl]benzamide
Catalog ID
STL147436
SMILES CCCCN(C(=O)c1cccc(c1)[N+](=O)[O-])Cc1cc2ccccc2[nH]c1=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 C21H21N3O4 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4/c1-2-3-11-23(21(26)16-8-6-9-18(13-16)24(27)28)14-17-12-15-7-4-5-10-19(15)22-20(17)25/h4-10,12-13H,2-3,11,14H2,1H3,(H,22,25)InChIKey
KWHIKFCKHFJWBB-UHFFFAOYSA-NSynonyms
674308-02-2674308022
CCCCN(C(=O)c1cccc(c1)(N+)(=O)(O))Cc1cc2ccccc2(nH)c1=O
CCCCN(CC1=CC2=CC=CC=C2NC1=O)C(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC21H21N3O4c1231123(21(26)1686918(1316)24(27)28)141712157451019(15)2220(17)25h4101213H231114H21H3(H2225)
MFCD04081824
Nbutyl3nitroN((2oxo12dihydroquinolin3yl)methyl)benzamide
NBUTYL3NITRON((2OXO1HQUINOLIN3YL)METHYL)BENZAMIDE
ZINC000013751235
ZINC13751235
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