2-(4-tert-butylphenyl)-6-chloranyl-3-phenylmethoxy-chromen-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-6-chloranyl-3-phenylmethoxy-chromen-4-one Openeye Name: 3-benzyloxy-2-(4-tert-butylphenyl)-6-chloro-chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-6-chloro-3-phenylmethoxy-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-6-chloro-3-phenylmethoxychromen-4-one Traditional Name: 3-benzoxy-2-(4-tert-butylphenyl)-6-chloro-chromone Formula: C26H23ClO3 MolecularWeight: 418.91202

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)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCC4=CC=CC=C4

InChI

InChI=1S/C26H23ClO3/c1-26(2,3)19-11-9-18(10-12-19)24-25(29-16-17-7-5-4-6-8-17)23(28)21-15-20(27)13-14-22(21)30-24/h4-15H,16H2,1-3H3