7-methyl-5-[(3-methylphenyl)methoxy]-4-propyl-chromen-2-one

Systemtic Name: 7-methyl-5-[(3-methylphenyl)methoxy]-4-propyl-chromen-2-one Openeye Name: 7-methyl-5-(m-tolylmethoxy)-4-propyl-chromen-2-one CAS Name: 7-methyl-5-[(3-methylphenyl)methoxy]-4-propyl-1-benzopyran-2-one IUPAC Name: 7-methyl-5-[(3-methylphenyl)methoxy]-4-propylchromen-2-one Traditional Name: 7-methyl-5-(3-methylbenzyl)oxy-4-propyl-coumarin Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC3=CC=CC(=C3)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OCC3=CC=CC(=C3)C

InChI

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