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

Systemtic Name: 7-[(4-tert-butylphenyl)methoxy]-3-hexyl-4,8-dimethyl-chromen-2-one Openeye Name: 7-[(4-tert-butylphenyl)methoxy]-3-hexyl-4,8-dimethyl-chromen-2-one CAS Name: 7-[(4-tert-butylphenyl)methoxy]-3-hexyl-4,8-dimethyl-1-benzopyran-2-one IUPAC Name: 7-[(4-tert-butylphenyl)methoxy]-3-hexyl-4,8-dimethylchromen-2-one Traditional Name: 7-(4-tert-butylbenzyl)oxy-3-hexyl-4,8-dimethyl-coumarin Formula: C28H36O3 MolecularWeight: 420.58364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36O3/c1-7-8-9-10-11-24-19(2)23-16-17-25(20(3)26(23)31-27(24)29)30-18-21-12-14-22(15-13-21)28(4,5)6/h12-17H,7-11,18H2,1-6H3