[3-(2-cyanophenyl)-2,6-dimethyl-phenyl]methyl methanesulfonate

Systemtic Name: [3-(2-cyanophenyl)-2,6-dimethyl-phenyl]methyl methanesulfonate Openeye Name: [3-(2-cyanophenyl)-2,6-dimethyl-phenyl]methyl methanesulfonate CAS Name: methanesulfonic acid [3-(2-cyanophenyl)-2,6-dimethylphenyl]methyl ester IUPAC Name: [3-(2-cyanophenyl)-2,6-dimethylphenyl]methyl methanesulfonate Traditional Name: methanesulfonic acid [3-(2-cyanophenyl)-2,6-dimethyl-benzyl] ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C2=CC=CC=C2C#N)C)COS(=O)(=O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C2=CC=CC=C2C#N)C)COS(=O)(=O)C

InChI

InChI=1S/C17H17NO3S/c1-12-8-9-15(16-7-5-4-6-14(16)10-18)13(2)17(12)11-21-22(3,19)20/h4-9H,11H2,1-3H3