4-[3-chloranyl-4-[4-(4-phenoxy-2-propyl-phenoxy)butoxy]phenyl]-1,3-thiazolidine-2,5-dione

Systemtic Name: 4-[3-chloranyl-4-[4-(4-phenoxy-2-propyl-phenoxy)butoxy]phenyl]-1,3-thiazolidine-2,5-dione Openeye Name: 4-[3-chloro-4-[4-(4-phenoxy-2-propyl-phenoxy)butoxy]phenyl]thiazolidine-2,5-dione CAS Name: 4-[3-chloro-4-[4-(4-phenoxy-2-propylphenoxy)butoxy]phenyl]thiazolidine-2,5-dione IUPAC Name: 4-[3-chloro-4-[4-(4-phenoxy-2-propylphenoxy)butoxy]phenyl]-1,3-thiazolidine-2,5-dione Traditional Name: 4-[3-chloro-4-[4-(4-phenoxy-2-propyl-phenoxy)butoxy]phenyl]thiazolidine-2,5-quinone Formula: C28H28ClNO5S MolecularWeight: 526.04362

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCCOC3=C(C=C(C=C3)C4C(=O)SC(=O)N4)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)OCCCCOC3=C(C=C(C=C3)C4C(=O)SC(=O)N4)Cl

InChI

InChI=1S/C28H28ClNO5S/c1-2-8-19-17-22(35-21-9-4-3-5-10-21)12-14-24(19)33-15-6-7-16-34-25-13-11-20(18-23(25)29)26-27(31)36-28(32)30-26/h3-5,9-14,17-18,26H,2,6-8,15-16H2,1H3,(H,30,32)