(4,8-dimethyl-2-oxidanylidene-chromen-7-yl) 4-(3-methylphenoxy)butanoate

Systemtic Name: (4,8-dimethyl-2-oxidanylidene-chromen-7-yl) 4-(3-methylphenoxy)butanoate Openeye Name: (4,8-dimethyl-2-oxo-chromen-7-yl) 4-(3-methylphenoxy)butanoate CAS Name: 4-(3-methylphenoxy)butanoic acid (4,8-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4,8-dimethyl-2-oxochromen-7-yl) 4-(3-methylphenoxy)butanoate Traditional Name: 4-(3-methylphenoxy)butyric acid (2-keto-4,8-dimethyl-chromen-7-yl) ester Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)OC2=C(C3=C(C=C2)C(=CC(=O)O3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)OC2=C(C3=C(C=C2)C(=CC(=O)O3)C)C

InChI

InChI=1S/C22H22O5/c1-14-6-4-7-17(12-14)25-11-5-8-20(23)26-19-10-9-18-15(2)13-21(24)27-22(18)16(19)3/h4,6-7,9-10,12-13H,5,8,11H2,1-3H3