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

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-phenylpropanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)CCC3=CC=CC=C3)C

InChI

InChI=1S/C21H20O4/c1-14-10-18-17(12-21(23)25-19(18)11-15(14)2)13-24-20(22)9-8-16-6-4-3-5-7-16/h3-7,10-12H,8-9,13H2,1-2H3