4-[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxybutanoate

Systemtic Name: 4-[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxybutanoate Openeye Name: 4-[3-(3-methylphenoxy)-4-oxo-chromen-7-yl]oxybutanoate CAS Name: 4-[[3-(3-methylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]butanoate IUPAC Name: 4-[3-(3-methylphenoxy)-4-oxochromen-7-yl]oxybutanoate Traditional Name: 4-[4-keto-3-(3-methylphenoxy)chromen-7-yl]oxybutyrate Formula: C20H17O6- MolecularWeight: 353.34538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCCCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCCCC(=O)[O-]

InChI

InChI=1S/C20H18O6/c1-13-4-2-5-15(10-13)26-18-12-25-17-11-14(7-8-16(17)20(18)23)24-9-3-6-19(21)22/h2,4-5,7-8,10-12H,3,6,9H2,1H3,(H,21,22)/p-1