7-[(2,5-dimethylphenyl)methoxy]-4-propyl-chromen-2-one

Systemtic Name: 7-[(2,5-dimethylphenyl)methoxy]-4-propyl-chromen-2-one Openeye Name: 7-[(2,5-dimethylphenyl)methoxy]-4-propyl-chromen-2-one CAS Name: 7-[(2,5-dimethylphenyl)methoxy]-4-propyl-1-benzopyran-2-one IUPAC Name: 7-[(2,5-dimethylphenyl)methoxy]-4-propylchromen-2-one Traditional Name: 7-(2,5-dimethylbenzyl)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)OCC3=C(C=CC(=C3)C)C

Isomeric SMILES

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

InChI

InChI=1S/C21H22O3/c1-4-5-16-11-21(22)24-20-12-18(8-9-19(16)20)23-13-17-10-14(2)6-7-15(17)3/h6-12H,4-5,13H2,1-3H3