3-[7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]propanoate

Systemtic Name: 3-[7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxidanylidene-chromen-3-yl]propanoate Openeye Name: 3-[7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxo-chromen-3-yl]propanoate CAS Name: 3-[7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxo-1-benzopyran-3-yl]propanoate IUPAC Name: 3-[7-[(3,5-dimethylphenyl)methoxy]-4-methyl-2-oxochromen-3-yl]propanoate Traditional Name: 3-[7-(3,5-dimethylbenzyl)oxy-2-keto-4-methyl-chromen-3-yl]propionate Formula: C22H21O5- MolecularWeight: 365.39914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)COC2=CC3=C(C=C2)C(=C(C(=O)O3)CCC(=O)[O-])C)C

Isomeric SMILES

CC1=CC(=CC(=C1)COC2=CC3=C(C=C2)C(=C(C(=O)O3)CCC(=O)[O-])C)C

InChI

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