Vitas-M small molecule compound

(2Z)-1-(3,5-dichlorophenyl)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)ethanone

Catalog ID
STK596839
SMILES Clc1cc(Cl)cc(c1)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2

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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 C18H13Cl2NO3 MW 362.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13Cl2NO3/c19-12-3-11(4-13(20)6-12)16(22)8-15-14-7-18-17(23-9-24-18)5-10(14)1-2-21-15/h3-8,21H,1-2,9H2/b15-8-
InChIKey
RRZHPXNPCDUKQH-NVNXTCNLSA-N
Synonyms
883953-22-8
(2Z)1(35dichlorophenyl)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)ethanone
(2Z)1(35dichlorophenyl)2(78dihydro6H(13)dioxolo(45g)isoquinolin5ylidene)ethanone
(Z)1(35dichlorophenyl)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)ethanone
883953228
C1CNC(=CC(=O)C2=CC(=CC(=C2)Cl)Cl)C3=CC4=C(C=C31)OCO4
Clc1cc(Cl)cc(c1)C(=O)C=C1NCCc2c1cc1OCOc1c2
InChI=1SC18H13Cl2NO3c1912311(413(20)612)16(22)8151471817(2392418)510(14)122115h3821H129H2b158
MFCD07639690
ZINC000005428274
ZINC05428274
ZINC5428274

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Available files

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