[4-(2-cyano-5-methyl-pyrrol-1-yl)phenyl]methyl methanesulfonate

Systemtic Name: [4-(2-cyano-5-methyl-pyrrol-1-yl)phenyl]methyl methanesulfonate Openeye Name: [4-(2-cyano-5-methyl-pyrrol-1-yl)phenyl]methyl methanesulfonate CAS Name: methanesulfonic acid [4-(2-cyano-5-methyl-1-pyrrolyl)phenyl]methyl ester IUPAC Name: [4-(2-cyano-5-methylpyrrol-1-yl)phenyl]methyl methanesulfonate Traditional Name: methanesulfonic acid [4-(2-cyano-5-methyl-pyrrol-1-yl)benzyl] ester Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)COS(=O)(=O)C)C#N

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)COS(=O)(=O)C)C#N

InChI

InChI=1S/C14H14N2O3S/c1-11-3-6-14(9-15)16(11)13-7-4-12(5-8-13)10-19-20(2,17)18/h3-8H,10H2,1-2H3