(2,5-dimethylphenyl)methyl 2-ethylsulfonylbenzoate

Systemtic Name: (2,5-dimethylphenyl)methyl 2-ethylsulfonylbenzoate Openeye Name: (2,5-dimethylphenyl)methyl 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid (2,5-dimethylbenzyl) ester Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C18H20O4S/c1-4-23(20,21)17-8-6-5-7-16(17)18(19)22-12-15-11-13(2)9-10-14(15)3/h5-11H,4,12H2,1-3H3