Vitas-M small molecule compound

N-[(1E)-3-[(2-hydroxyethyl)amino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide

Catalog ID
STK832575
SMILES OCCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1

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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 C18H17N3O5 MW 355.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O5/c22-10-9-19-18(24)16(20-17(23)14-6-2-1-3-7-14)12-13-5-4-8-15(11-13)21(25)26/h1-8,11-12,22H,9-10H2,(H,19,24)(H,20,23)/b16-12+
InChIKey
WAUJJVUGGYGTCY-FOWTUZBSSA-N
Synonyms
304875-30-7
(E)N(3((2hydroxyethyl)amino)1(3nitrophenyl)3oxoprop1en2yl)benzamide
304875307
C1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)(N+)(=O)(O))C(=O)NCCO
InChI=1SC18H17N3O5c221091918(24)16(2017(23)146213714)121354815(1113)21(25)26h18111222H910H2(H1924)(H2023)b1612+
MFCD00699041
N((1E)3((2hydroxyethyl)amino)1(3nitrophenyl)3oxoprop1en2yl)benzamide
N((E)3(2HYDROXYETHYLAMINO)1(3NITROPHENYL)3OXOPROP1EN2YL)BENZAMIDE
N(1(2HYDROXYETHYLCARBAMOYL)2(3NITROPHENYL)VINYL)BENZAMIDE
OCCNC(=O)C(=Cc1cccc(c1)(N+)(=O)(O))NC(=O)c1ccccc1
ZINC000001830854
ZINC01830854
ZINC1830854

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Available files

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