[2-(imidazol-1-ylmethyl)-2-phenethyl-1,3-dioxolan-4-yl]methyl methanesulfonate

Systemtic Name: [2-(imidazol-1-ylmethyl)-2-phenethyl-1,3-dioxolan-4-yl]methyl methanesulfonate Openeye Name: [2-(imidazol-1-ylmethyl)-2-phenethyl-1,3-dioxolan-4-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [2-(1-imidazolylmethyl)-2-phenethyl-1,3-dioxolan-4-yl]methyl ester IUPAC Name: [2-(imidazol-1-ylmethyl)-2-phenethyl-1,3-dioxolan-4-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [2-(imidazol-1-ylmethyl)-2-phenethyl-1,3-dioxolan-4-yl]methyl ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1COC(O1)(CCC2=CC=CC=C2)CN3C=CN=C3

Isomeric SMILES

CS(=O)(=O)OCC1COC(O1)(CCC2=CC=CC=C2)CN3C=CN=C3

InChI

InChI=1S/C17H22N2O5S/c1-25(20,21)23-12-16-11-22-17(24-16,13-19-10-9-18-14-19)8-7-15-5-3-2-4-6-15/h2-6,9-10,14,16H,7-8,11-13H2,1H3