Vitas-M small molecule compound
9-(3-bromo-4-methylphenyl)-2,3,8,9-tetrahydro[1,4]dioxino[2,3-g]quinolin-7(6H)-one
Catalog ID
STK405919
SMILES O=C1Nc2cc3OCCOc3cc2C(C1)c1ccc(c(c1)Br)C
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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 C18H16BrNO3 MW 374.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrNO3/c1-10-2-3-11(6-14(10)19)12-8-18(21)20-15-9-17-16(7-13(12)15)22-4-5-23-17/h2-3,6-7,9,12H,4-5,8H2,1H3,(H,20,21)InChIKey
CKYKFCXKSOHWRB-UHFFFAOYSA-NSynonyms
9(3bromo4methylphenyl)2389tetrahydro(14)dioxino(23g)quinolin7(6H)one
9(3bromo4methylphenyl)3689tetrahydro2H(14)dioxino(23g)quinolin7one
9(3BROMO4METHYLPHENYL)689TRIHYDRO2H3H14DIOXANO(56G)QUINOLIN7ONE
CC1=C(C=C(C=C1)C2CC(=O)NC3=CC4=C(C=C23)OCCO4)Br
InChI=1SC18H16BrNO3c1102311(614(10)19)12818(21)201591716(713(12)15)22452317h2367912H458H21H3(H2021)
MFCD06754602
ZINC000004912357
ZINC000004912361
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