2-[2-oxidanylidene-3,6-bis(phenylmethyl)-1,4-oxathian-3-yl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-3,6-bis(phenylmethyl)-1,4-oxathian-3-yl]ethanoic acid Openeye Name: 2-(3,6-dibenzyl-2-oxo-1,4-oxathian-3-yl)acetic acid CAS Name: 2-[2-oxo-3,6-bis(phenylmethyl)-1,4-oxathian-3-yl]acetic acid IUPAC Name: 2-(3,6-dibenzyl-2-oxo-1,4-oxathian-3-yl)acetic acid Traditional Name: 2-(3,6-dibenzyl-2-keto-1,4-oxathian-3-yl)acetic acid Formula: C20H20O4S MolecularWeight: 356.4354

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C(S1)(CC2=CC=CC=C2)CC(=O)O)CC3=CC=CC=C3

Isomeric SMILES

C1C(OC(=O)C(S1)(CC2=CC=CC=C2)CC(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C20H20O4S/c21-18(22)13-20(12-16-9-5-2-6-10-16)19(23)24-17(14-25-20)11-15-7-3-1-4-8-15/h1-10,17H,11-14H2,(H,21,22)