Vitas-M small molecule compound
1-[2-(4-benzylpiperidin-1-yl)-5-nitrophenyl]-3,4-dihydroisoquinoline
Catalog ID
STK723601
SMILES [O-][N+](=O)c1ccc(c(c1)C1=NCCc2c1cccc2)N1CCC(CC1)Cc1ccccc1
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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 C27H27N3O2 MW 425.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O2/c31-30(32)23-10-11-26(25(19-23)27-24-9-5-4-8-22(24)12-15-28-27)29-16-13-21(14-17-29)18-20-6-2-1-3-7-20/h1-11,19,21H,12-18H2InChIKey
CCYNXULFQVKPQT-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(c(c1)C1=NCCc2c1cccc2)N1CCC(CC1)Cc1ccccc1
1(2(4benzylpiperidin1yl)5nitrophenyl)34dihydroisoquinoline
1(5NITRO2(4BENZYLPIPERIDYL)PHENYL)34DIHYDROISOQUINOLINE
C1CN(CCC1CC2=CC=CC=C2)C3=C(C=C(C=C3)(N+)(=O)(O))C4=NCCC5=CC=CC=C54
InChI=1SC27H27N3O2c3130(32)23101126(25(1923)2724954822(24)12152827)29161321(141729)18206213720h1111921H1218H2
MFCD03763506
ZINC000004575044
ZINC4575044
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