[(2S,4S)-2-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl methanesulfonate

Systemtic Name: [(2S,4S)-2-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl methanesulfonate Openeye Name: [(2S,4S)-2-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [(2S,4S)-2-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl ester IUPAC Name: [(2S,4S)-2-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(2S,4S)-2-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1,3-dioxolan-4-yl]methyl ester Formula: C14H16ClN3O5S MolecularWeight: 373.81194

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1COC(O1)(CN2C=NC=N2)C3=CC=CC=C3Cl

Isomeric SMILES

CS(=O)(=O)OC[C@@H]1CO[C@@](O1)(CN2C=NC=N2)C3=CC=CC=C3Cl

InChI

InChI=1S/C14H16ClN3O5S/c1-24(19,20)22-7-11-6-21-14(23-11,8-18-10-16-9-17-18)12-4-2-3-5-13(12)15/h2-5,9-11H,6-8H2,1H3/t11-,14+/m0/s1