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

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-phenylbutanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C)C

InChI

InChI=1S/C22H22O4/c1-4-18(16-8-6-5-7-9-16)22(24)25-13-17-12-21(23)26-20-11-15(3)14(2)10-19(17)20/h5-12,18H,4,13H2,1-3H3