7-[(2,5-dimethylphenyl)methoxy]-3-hexyl-4,8-dimethyl-chromen-2-one

Systemtic Name: 7-[(2,5-dimethylphenyl)methoxy]-3-hexyl-4,8-dimethyl-chromen-2-one Openeye Name: 7-[(2,5-dimethylphenyl)methoxy]-3-hexyl-4,8-dimethyl-chromen-2-one CAS Name: 7-[(2,5-dimethylphenyl)methoxy]-3-hexyl-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 7-[(2,5-dimethylphenyl)methoxy]-3-hexyl-4,8-dimethylchromen-2-one Traditional Name: 7-(2,5-dimethylbenzyl)oxy-3-hexyl-4,8-dimethyl-coumarin Formula: C26H32O3 MolecularWeight: 392.53048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C(=C(C=C2)OCC3=C(C=CC(=C3)C)C)C)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C(=C(C=C2)OCC3=C(C=CC(=C3)C)C)C)OC1=O)C

InChI

InChI=1S/C26H32O3/c1-6-7-8-9-10-23-19(4)22-13-14-24(20(5)25(22)29-26(23)27)28-16-21-15-17(2)11-12-18(21)3/h11-15H,6-10,16H2,1-5H3