7-[(4-tert-butylphenyl)methoxy]-4-methyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 7-[(4-tert-butylphenyl)methoxy]-4-methyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-7-[(4-tert-butylphenyl)methoxy]-4-methyl-chromen-2-one CAS Name: 7-[(4-tert-butylphenyl)methoxy]-4-methyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-7-[(4-tert-butylphenyl)methoxy]-4-methylchromen-2-one Traditional Name: 3-benzyl-7-(4-tert-butylbenzyl)oxy-4-methyl-coumarin Formula: C28H28O3 MolecularWeight: 412.52012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(C)(C)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(C)(C)C)CC4=CC=CC=C4

InChI

InChI=1S/C28H28O3/c1-19-24-15-14-23(30-18-21-10-12-22(13-11-21)28(2,3)4)17-26(24)31-27(29)25(19)16-20-8-6-5-7-9-20/h5-15,17H,16,18H2,1-4H3