Vitas-M small molecule compound
1-(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)-2-(4-nitrophenoxy)propan-1-one
Catalog ID
STL174982
SMILES CC(C(=O)N1CCC2(CC1)OCCO2)Oc1ccc(cc1)[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 C16H20N2O6 MW 336.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O6/c1-12(24-14-4-2-13(3-5-14)18(20)21)15(19)17-8-6-16(7-9-17)22-10-11-23-16/h2-5,12H,6-11H2,1H3InChIKey
OCRVDHUHKFAYKC-UHFFFAOYSA-NSynonyms
938021-11-51(14dioxa8azaspiro(45)dec8yl)2(4nitrophenoxy)propan1one
1(14dioxa8azaspiro(45)decan8yl)2(4nitrophenoxy)propan1one
938021115
CC(C(=O)N1CCC2(CC1)OCCO2)Oc1ccc(cc1)(N+)(=O)(O)
CC(C(=O)N1CCC2(CC1)OCCO2)OC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H20N2O6c112(24144213(3514)18(20)21)15(19)178616(7917)2210112316h2512H611H21H3
MFCD08557717
ZINC000020606259
ZINC000020606261
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