3-[4,8-dimethyl-7-[(3-methylphenyl)methoxy]-2-oxidanylidene-chromen-3-yl]propanoic acid

Systemtic Name: 3-[4,8-dimethyl-7-[(3-methylphenyl)methoxy]-2-oxidanylidene-chromen-3-yl]propanoic acid Openeye Name: 3-[4,8-dimethyl-7-(m-tolylmethoxy)-2-oxo-chromen-3-yl]propanoic acid CAS Name: 3-[4,8-dimethyl-7-[(3-methylphenyl)methoxy]-2-oxo-1-benzopyran-3-yl]propanoic acid IUPAC Name: 3-[4,8-dimethyl-7-[(3-methylphenyl)methoxy]-2-oxochromen-3-yl]propanoic acid Traditional Name: 3-[2-keto-4,8-dimethyl-7-(3-methylbenzyl)oxy-chromen-3-yl]propionic acid Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=C(C3=C(C=C2)C(=C(C(=O)O3)CCC(=O)O)C)C

Isomeric SMILES

CC1=CC(=CC=C1)COC2=C(C3=C(C=C2)C(=C(C(=O)O3)CCC(=O)O)C)C

InChI

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