Vitas-M small molecule compound
1-(2,3-dihydro-1,4-benzodioxin-2-yl)-N-(3-nitrobenzyl)ethanamine
Catalog ID
STK527594
SMILES CC(C1COc2c(O1)cccc2)NCc1cccc(c1)[N+](=O)[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 C17H18N2O4 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O4/c1-12(17-11-22-15-7-2-3-8-16(15)23-17)18-10-13-5-4-6-14(9-13)19(20)21/h2-9,12,17-18H,10-11H2,1H3InChIKey
WTVGZZNFMMZVQM-UHFFFAOYSA-NSynonyms
1(23dihydro14benzodioxin2yl)N(3nitrobenzyl)ethanamine
1(23DIHYDRO14BENZODIOXIN3YL)N((3NITROPHENYL)METHYL)ETHANAMINE
1(23dihydrobenzo(b)(14)dioxin2yl)N(3nitrobenzyl)ethanaminehemioxalate
CC(C1COC2=CC=CC=C2O1)NCC3=CC(=CC=C3)(N+)(=O)(O)
CC(C1COc2c(O1)cccc2)NCc1cccc(c1)(N+)(=O)(O)
CC(C1COc2c(O1)cccc2)NCc1cccc(c1)(N+)(=O)(O)CC(C1COc2c(O1)cccc2)NCc1cccc(c1)(N+)(=O)(O)OC(=O)C(=O)O
InChI=1SC17H18N2O4c112(17112215723816(15)2317)18101354614(913)19(20)21h29121718H1011H21H3
MFCD00698725
ZINC000055425588
ZINC000055425600
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