1-phenylethyl 4-methylsulfonylbenzoate

Systemtic Name: 1-phenylethyl 4-methylsulfonylbenzoate Openeye Name: 1-phenylethyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid 1-phenylethyl ester IUPAC Name: 1-phenylethyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid 1-phenylethyl ester Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C16H16O4S/c1-12(13-6-4-3-5-7-13)20-16(17)14-8-10-15(11-9-14)21(2,18)19/h3-12H,1-2H3