methyl 2-[4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl]oxyethanoate

Systemtic Name: methyl 2-[4,7-dimethyl-2-oxidanylidene-3-(phenylmethyl)chromen-5-yl]oxyethanoate Openeye Name: methyl 2-(3-benzyl-4,7-dimethyl-2-oxo-chromen-5-yl)oxyacetate CAS Name: 2-[[4,7-dimethyl-2-oxo-3-(phenylmethyl)-1-benzopyran-5-yl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-(3-benzyl-4,7-dimethyl-2-oxochromen-5-yl)oxyacetate Traditional Name: 2-(3-benzyl-2-keto-4,7-dimethyl-chromen-5-yl)oxyacetic acid methyl ester Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC(=O)OC

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC3=CC=CC=C3)C)C(=C1)OCC(=O)OC

InChI

InChI=1S/C21H20O5/c1-13-9-17(25-12-19(22)24-3)20-14(2)16(21(23)26-18(20)10-13)11-15-7-5-4-6-8-15/h4-10H,11-12H2,1-3H3