Vitas-M small molecule compound

5,5-dimethyl-2-(3,3,5-trimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)cyclohexane-1,3-dione

Catalog ID
STK791097
SMILES O=C1CC(C)(C)CC(=O)C1=C1NC(C)(C)Cc2c1cccc2C

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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 C20H25NO2 MW 311.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO2/c1-12-7-6-8-13-14(12)9-20(4,5)21-18(13)17-15(22)10-19(2,3)11-16(17)23/h6-8,21H,9-11H2,1-5H3
InChIKey
ALHPXVJBYQCZJZ-UHFFFAOYSA-N
Synonyms
309741-13-7
309741137
55DIMETHYL2(335TRIMETHYL24DIHYDROISOQUINOLIN1YLIDENE)CYCLOHEXANE13DIONE
55DIMETHYL2(335TRIMETHYL34DIHYDRO1(2H)ISOQUINOLINYLIDENE)13CYCLOHEXANEDIONE
55DIMETHYL2(335TRIMETHYL34DIHYDRO2HISOQUINOLIN1YLIDENE)CYCLOHEXANE13DIONE
55dimethyl2(335trimethyl34dihydroisoquinolin1(2H)ylidene)cyclohexane13dione
CC1=CC=CC2=C1CC(NC2=C3C(=O)CC(CC3=O)(C)C)(C)C
InChI=1SC20H25NO2c1127681314(12)920(45)2118(13)1715(22)1019(23)1116(17)23h6821H911H215H3
MFCD01975117
ZINC000100093068
ZINC100093068

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Available files

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