6-chloranyl-2-(4-methylphenyl)-3-(4-phenoxybutoxy)chromen-4-one

Systemtic Name: 6-chloranyl-2-(4-methylphenyl)-3-(4-phenoxybutoxy)chromen-4-one Openeye Name: 6-chloro-3-(4-phenoxybutoxy)-2-(p-tolyl)chromen-4-one CAS Name: 6-chloro-2-(4-methylphenyl)-3-(4-phenoxybutoxy)-1-benzopyran-4-one IUPAC Name: 6-chloro-2-(4-methylphenyl)-3-(4-phenoxybutoxy)chromen-4-one Traditional Name: 6-chloro-3-(4-phenoxybutoxy)-2-(p-tolyl)chromone Formula: C26H23ClO4 MolecularWeight: 434.91142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCCCCOC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=CC(=C3)Cl)OCCCCOC4=CC=CC=C4

InChI

InChI=1S/C26H23ClO4/c1-18-9-11-19(12-10-18)25-26(24(28)22-17-20(27)13-14-23(22)31-25)30-16-6-5-15-29-21-7-3-2-4-8-21/h2-4,7-14,17H,5-6,15-16H2,1H3