(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-ethoxy-4-propoxy-benzoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 3-ethoxy-4-propoxy-benzoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 3-ethoxy-4-propoxy-benzoate CAS Name: 3-ethoxy-4-propoxybenzoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 3-ethoxy-4-propoxybenzoate Traditional Name: 3-ethoxy-4-propoxy-benzoic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C22H22O7 MolecularWeight: 398.40588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)OCC

InChI

InChI=1S/C22H22O7/c1-3-9-27-18-8-5-14(10-20(18)26-4-2)22(25)28-13-15-11-21(24)29-19-12-16(23)6-7-17(15)19/h5-8,10-12,23H,3-4,9,13H2,1-2H3