2-(4-chlorophenyl)-2-[4-(3,4-dihydro-2H-thiochromen-4-yl)phenoxy]ethanoic acid

Systemtic Name: 2-(4-chlorophenyl)-2-[4-(3,4-dihydro-2H-thiochromen-4-yl)phenoxy]ethanoic acid Openeye Name: 2-(4-chlorophenyl)-2-(4-thiochroman-4-ylphenoxy)acetic acid CAS Name: 2-(4-chlorophenyl)-2-[4-(3,4-dihydro-2H-1-benzothiopyran-4-yl)phenoxy]acetic acid IUPAC Name: 2-(4-chlorophenyl)-2-[4-(3,4-dihydro-2H-thiochromen-4-yl)phenoxy]acetic acid Traditional Name: 2-(4-chlorophenyl)-2-(4-thiochroman-4-ylphenoxy)acetic acid Formula: C23H19ClO3S MolecularWeight: 410.91316

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1C3=CC=C(C=C3)OC(C4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

C1CSC2=CC=CC=C2C1C3=CC=C(C=C3)OC(C4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C23H19ClO3S/c24-17-9-5-16(6-10-17)22(23(25)26)27-18-11-7-15(8-12-18)19-13-14-28-21-4-2-1-3-20(19)21/h1-12,19,22H,13-14H2,(H,25,26)