(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 4-butoxybenzoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 4-butoxybenzoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C22H22O6 MolecularWeight: 382.40648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C22H22O6/c1-3-4-11-26-17-7-5-15(6-8-17)22(24)27-14-16-12-21(23)28-20-13-18(25-2)9-10-19(16)20/h5-10,12-13H,3-4,11,14H2,1-2H3