2-(4-tert-butylphenyl)-6-chloranyl-3-(2-oxidanylidene-2-thiophen-2-yl-ethoxy)chromen-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-6-chloranyl-3-(2-oxidanylidene-2-thiophen-2-yl-ethoxy)chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-6-chloro-3-[2-oxo-2-(2-thienyl)ethoxy]chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-6-chloro-3-(2-oxo-2-thiophen-2-ylethoxy)-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-6-chloro-3-(2-oxo-2-thiophen-2-ylethoxy)chromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-6-chloro-3-[2-keto-2-(2-thienyl)ethoxy]chromone Formula: C25H21ClO4S MolecularWeight: 452.94984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC(=O)C4=CC=CS4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC(=O)C4=CC=CS4

InChI

InChI=1S/C25H21ClO4S/c1-25(2,3)16-8-6-15(7-9-16)23-24(29-14-19(27)21-5-4-12-31-21)22(28)18-13-17(26)10-11-20(18)30-23/h4-13H,14H2,1-3H3