Vitas-M small molecule compound
azepan-1-yl(5-chloro-1H-indol-3-yl)acetic acid
Catalog ID
STK647175
SMILES OC(=O)C(c1c[nH]c2c1cc(Cl)cc2)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 C16H19ClN2O2 MW 306.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19ClN2O2/c17-11-5-6-14-12(9-11)13(10-18-14)15(16(20)21)19-7-3-1-2-4-8-19/h5-6,9-10,15,18H,1-4,7-8H2,(H,20,21)InChIKey
HJTLWRQLRDYNAV-UHFFFAOYSA-NSynonyms
1010907-96-61010907966
2(azepan1yl)2(5chloro1Hindol3yl)aceticacid
azepan1yl(5chloro1Hindol3yl)aceticacid
C1CCCN(CC1)C(C2=CNC3=C2C=C(C=C3)Cl)C(=O)O
InChI=1SC16H19ClN2O2c1711561412(911)13(101814)15(16(20)21)1973124819h569101518H1478H2(H2021)
MFCD12203061
OC(=O)C(c1c(nH)c2c1cc(Cl)cc2)N1CCCCCC1
ZINC000012391712
ZINC000012391713
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