(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-phenoxypropanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-phenoxypropanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 3-phenoxypropanoate CAS Name: 3-phenoxypropanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 3-phenoxypropanoate Traditional Name: 3-phenoxypropionic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCOC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCOC3=CC=CC=C3)C

InChI

InChI=1S/C21H20O5/c1-14-10-18-16(12-21(23)26-19(18)11-15(14)2)13-25-20(22)8-9-24-17-6-4-3-5-7-17/h3-7,10-12H,8-9,13H2,1-2H3