Vitas-M small molecule compound

1-[1-(3-nitrobenzyl)piperidin-4-yl]azepane

Catalog ID
STK171324
SMILES [O-][N+](=O)c1cccc(c1)CN1CCC(CC1)N1CCCCCC1

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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 C18H27N3O2 MW 317.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3O2/c22-21(23)18-7-5-6-16(14-18)15-19-12-8-17(9-13-19)20-10-3-1-2-4-11-20/h5-7,14,17H,1-4,8-13,15H2
InChIKey
MLSZMPZIQOYRLC-UHFFFAOYSA-N
Synonyms
431996-27-9
(1((3NITROPHENYL)METHYL)4PIPERIDYL)AZAPERHYDROEPINE
(O)(N+)(=O)c1cccc(c1)CN1CCC(CC1)N1CCCCCC1
(O)(N+)(=O)c1cccc(c1)CN1CCC(CC1)N1CCCCCC1OC(=O)C(=O)O
1(1((3NITROPHENYL)METHYL)PIPERIDIN4YL)AZEPANE
1(1(3NITROBENZYL)4PIPERIDINYL)AZEPANE
1(1(3NITROBENZYL)PIPERIDIN4YL)AZEPANE
1(1(3nitrobenzyl)piperidin4yl)azepaneoxalate
431996279
C1CCCN(CC1)C2CCN(CC2)CC3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC18H27N3O2c2221(23)1875616(1418)151912817(91319)201031241120h571417H1481315H2
MFCD03141434
ZINC000004703437
ZINC4703437

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Available files

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