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

Systemtic Name: 5-[(2,5-dimethylphenyl)methoxy]-4,7-dimethyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-5-[(2,5-dimethylphenyl)methoxy]-4,7-dimethyl-chromen-2-one CAS Name: 5-[(2,5-dimethylphenyl)methoxy]-4,7-dimethyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-5-[(2,5-dimethylphenyl)methoxy]-4,7-dimethylchromen-2-one Traditional Name: 3-benzyl-5-(2,5-dimethylbenzyl)oxy-4,7-dimethyl-coumarin Formula: C27H26O3 MolecularWeight: 398.49354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC2=CC(=CC3=C2C(=C(C(=O)O3)CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC2=CC(=CC3=C2C(=C(C(=O)O3)CC4=CC=CC=C4)C)C

InChI

InChI=1S/C27H26O3/c1-17-10-11-19(3)22(12-17)16-29-24-13-18(2)14-25-26(24)20(4)23(27(28)30-25)15-21-8-6-5-7-9-21/h5-14H,15-16H2,1-4H3