methyl 4-methylbenzenesulfonate; 2-methyl-1-(phenylmethyl)imidazole

Systemtic Name: methyl 4-methylbenzenesulfonate; 2-methyl-1-(phenylmethyl)imidazole Openeye Name: 1-benzyl-2-methyl-imidazole; methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid methyl ester; 2-methyl-1-(phenylmethyl)imidazole IUPAC Name: 1-benzyl-2-methylimidazole; methyl 4-methylbenzenesulfonate Traditional Name: 1-benzyl-2-methyl-imidazole; 4-methylbenzenesulfonic acid methyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC.CC1=NC=CN1CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC.CC1=NC=CN1CC2=CC=CC=C2

InChI

InChI=1S/C11H12N2.C8H10O3S/c1-10-12-7-8-13(10)9-11-5-3-2-4-6-11;1-7-3-5-8(6-4-7)12(9,10)11-2/h2-8H,9H2,1H3;3-6H,1-2H3