Vitas-M small molecule compound

1-methyl-2-[2-(4-methylphenyl)-2-oxoethyl]isoquinolinium

Catalog ID
STK074517
SMILES Cc1ccc(cc1)C(=O)C[n+]1ccc2c(c1C)cccc2

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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 C19H18NO MW 276.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18NO/c1-14-7-9-17(10-8-14)19(21)13-20-12-11-16-5-3-4-6-18(16)15(20)2/h3-12H,13H2,1-2H3/q+1
InChIKey
FCYMCVLBKMOTFU-UHFFFAOYSA-N
Synonyms

1METHYL2(2(4METHYLPHENYL)2OXOETHYL)ISOQUINOLINIUM
1methyl2(2oxo2(ptolyl)ethyl)isoquinolin2iumbromide
1METHYL2(2OXO2PTOLYLETHYL)ISOQUINOLINIUM
2(1METHYL(2ISOQUINOLYL))1(4METHYLPHENYL)ETHAN1ONE
2(1METHYLISOQUINOLIN2IUM2YL)1(4METHYLPHENYL)ETHANONE
CC1=CC=C(C=C1)C(=O)C(N+)2=C(C3=CC=CC=C3C=C2)C
Cc1ccc(cc1)C(=O)C(n+)1ccc2c(c1C)cccc2
Cc1ccc(cc1)C(=O)C(n+)1ccc2c(c1C)cccc2(Br)
InChI=1SC19H18NOc1147917(10814)19(21)1320121116534618(16)15(20)2h312H13H212H3q+1
MFCD01879397
STK074517
ZINC000001817017
ZINC01817017
ZINC1817017

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Available files

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