Vitas-M small molecule compound
(2Z)-1-phenyl-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Catalog ID
STK588192
SMILES O=C(c1ccccc1)/C=C/1\NCCc2c1cc1OCCCOc1c2
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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 C20H19NO3 MW 321.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO3/c22-18(14-5-2-1-3-6-14)13-17-16-12-20-19(23-9-4-10-24-20)11-15(16)7-8-21-17/h1-3,5-6,11-13,21H,4,7-10H2/b17-13-InChIKey
FYZUJLQOIDMTMM-LGMDPLHJSA-NSynonyms
883952-06-5(2Z)1phenyl2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
(2Z)2(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)1phenylethanone
(Z)1phenyl2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
883952065
C1COC2=C(C=C3C(=C2)CCNC3=CC(=O)C4=CC=CC=C4)OC1
InChI=1SC20H19NO3c2218(145213614)131716122019(2394102420)1115(16)782117h1356111321H4710H2b1713
MFCD07640312
O=C(c1ccccc1)C=C1NCCc2c1cc1OCCCOc1c2
ZINC000005450871
ZINC05450871
ZINC5450871
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