3-[7-[(2,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxidanylidene-chromen-3-yl]propanoate

Systemtic Name: 3-[7-[(2,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxidanylidene-chromen-3-yl]propanoate Openeye Name: 3-[7-[(2,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxo-chromen-3-yl]propanoate CAS Name: 3-[7-[(2,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxo-1-benzopyran-3-yl]propanoate IUPAC Name: 3-[7-[(2,5-dimethylphenyl)methoxy]-4,8-dimethyl-2-oxochromen-3-yl]propanoate Traditional Name: 3-[7-(2,5-dimethylbenzyl)oxy-2-keto-4,8-dimethyl-chromen-3-yl]propionate Formula: C23H23O5- MolecularWeight: 379.42572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24O5/c1-13-5-6-14(2)17(11-13)12-27-20-9-7-18-15(3)19(8-10-21(24)25)23(26)28-22(18)16(20)4/h5-7,9,11H,8,10,12H2,1-4H3,(H,24,25)/p-1