Vitas-M small molecule compound
4-cyanophenyl 4-butoxy-2-chlorobenzoate
Catalog ID
STK074423
SMILES CCCCOc1ccc(c(c1)Cl)C(=O)Oc1ccc(cc1)C#N
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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 C18H16ClNO3 MW 329.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClNO3/c1-2-3-10-22-15-8-9-16(17(19)11-15)18(21)23-14-6-4-13(12-20)5-7-14/h4-9,11H,2-3,10H2,1H3InChIKey
LFBNSGULXRERCQ-UHFFFAOYSA-NSynonyms
(4CYANOPHENYL)4BUTOXY2CHLOROBENZOATE
4CYANOPHENYL4BUTOXY2CHLOROBENZOATE
CCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N)Cl
CCCCOc1ccc(c(c1)Cl)C(=O)Oc1ccc(cc1)C#N
InChI=1SC18H16ClNO3c1231022158916(17(19)1115)18(21)23146413(1220)5714h4911H2310H21H3
MFCD00994630
STK074423
ZINC000004600139
ZINC04600139
ZINC4600139
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