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

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-phenylpropanoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C20H18O4 MolecularWeight: 322.35452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H18O4/c1-14-7-9-17-16(12-20(22)24-18(17)11-14)13-23-19(21)10-8-15-5-3-2-4-6-15/h2-7,9,11-12H,8,10,13H2,1H3