This chemical is called Benzene, 1-[isocyano[(4-methylphenyl)sulfonyl]methyl]-2-methoxy-, and its systematic name is 1-{isocyano[(4-methylphenyl)sulfonyl]methyl}-2-methoxybenzene. With the molecular formula of C16H15NO3S, its molecular weight is 301.36. The CAS registry number of this chemical is 263389-53-3.
Other characteristics of the Benzene, 1-[isocyano[(4-methylphenyl)sulfonyl]methyl]-2-methoxy- can be summarised as followings: (1)#H bond acceptors: 4 #H bond donors: 0; (2)#Freely Rotating Bonds: 4 Polar Surface Area: 56.11 Å2.
You can still convert the following datas into molecular structure:
1.SMILES: O=S(=O)(c1ccc(cc1)C)C([N+]#[C-])c2ccccc2OC
2.InChI: InChI=1/C16H15NO3S/c1-12-8-10-13(11-9-12)21(18,19)16(17-2)14-6-4-5-7-15(14)20-3/h4-11,16H,1,3H3
3.InChIKey: BTXVFJYPHAIAST-UHFFFAOYAE
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