Vitas-M small molecule compound
N-benzyl-7-nitro-1,2,3,4-tetrahydro-4aH-xanthen-4a-amine
Catalog ID
STK793018
SMILES [O-][N+](=O)c1ccc2c(c1)C=C1C(O2)(CCCC1)NCc1ccccc1
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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 C20H20N2O3 MW 336.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O3/c23-22(24)18-9-10-19-16(13-18)12-17-8-4-5-11-20(17,25-19)21-14-15-6-2-1-3-7-15/h1-3,6-7,9-10,12-13,21H,4-5,8,11,14H2InChIKey
UTPFNWORGGINAJ-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c(c1)C=C1C(O2)(CCCC1)NCc1ccccc1
C1CCC2(C(=CC3=C(O2)C=CC(=C3)(N+)(=O)(O))C1)NCC4=CC=CC=C4
InChI=1SC20H20N2O3c2322(24)189101916(1318)12178451120(172519)2114156213715h1367910121321H4581114H2
MFCD02106301
Nbenzyl7nitro1234tetrahydro4aHxanthen4aamine
Nbenzyl7nitro1234tetrahydroxanthen4aamine
Nbenzyl7nitro2344atetrahydro1Hxanthen4aamine
ZINC000055443945
ZINC000055443947
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