quinolin-8-ylmethyl 3-methylsulfonylbenzoate

Systemtic Name: quinolin-8-ylmethyl 3-methylsulfonylbenzoate Openeye Name: 8-quinolylmethyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid 8-quinolylmethyl ester Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OCC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C18H15NO4S/c1-24(21,22)16-9-3-6-14(11-16)18(20)23-12-15-7-2-5-13-8-4-10-19-17(13)15/h2-11H,12H2,1H3