3-(dimethylamino)propyl 2-(4-oxidanylthian-4-yl)-2-phenyl-ethanoate

Systemtic Name: 3-(dimethylamino)propyl 2-(4-oxidanylthian-4-yl)-2-phenyl-ethanoate Openeye Name: 3-(dimethylamino)propyl 2-(4-hydroxytetrahydrothiopyran-4-yl)-2-phenyl-acetate CAS Name: 2-(4-hydroxy-4-thianyl)-2-phenylacetic acid 3-(dimethylamino)propyl ester IUPAC Name: 3-(dimethylamino)propyl 2-(4-hydroxythian-4-yl)-2-phenylacetate Traditional Name: 2-(4-hydroxytetrahydrothiopyran-4-yl)-2-phenyl-acetic acid 3-(dimethylamino)propyl ester Formula: C18H27NO3S MolecularWeight: 337.47688

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC(=O)C(C1=CC=CC=C1)C2(CCSCC2)O

Isomeric SMILES

CN(C)CCCOC(=O)C(C1=CC=CC=C1)C2(CCSCC2)O

InChI

InChI=1S/C18H27NO3S/c1-19(2)11-6-12-22-17(20)16(15-7-4-3-5-8-15)18(21)9-13-23-14-10-18/h3-5,7-8,16,21H,6,9-14H2,1-2H3