4-[(4-tert-butylphenoxy)methyl]-7-methyl-chromen-2-one

Systemtic Name: 4-[(4-tert-butylphenoxy)methyl]-7-methyl-chromen-2-one Openeye Name: 4-[(4-tert-butylphenoxy)methyl]-7-methyl-chromen-2-one CAS Name: 4-[(4-tert-butylphenoxy)methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[(4-tert-butylphenoxy)methyl]-7-methylchromen-2-one Traditional Name: 4-[(4-tert-butylphenoxy)methyl]-7-methyl-coumarin Formula: C21H22O3 MolecularWeight: 322.39758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H22O3/c1-14-5-10-18-15(12-20(22)24-19(18)11-14)13-23-17-8-6-16(7-9-17)21(2,3)4/h5-12H,13H2,1-4H3