ethyl (2R)-2-(4-oxidanylidene-6-propyl-3-pyridin-2-yl-chromen-7-yl)oxypropanoate

Systemtic Name: ethyl (2R)-2-(4-oxidanylidene-6-propyl-3-pyridin-2-yl-chromen-7-yl)oxypropanoate Openeye Name: ethyl (2R)-2-[4-oxo-6-propyl-3-(2-pyridyl)chromen-7-yl]oxypropanoate CAS Name: (2R)-2-[[4-oxo-6-propyl-3-(2-pyridinyl)-1-benzopyran-7-yl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-(4-oxo-6-propyl-3-pyridin-2-ylchromen-7-yl)oxypropanoate Traditional Name: (2R)-2-[4-keto-6-propyl-3-(2-pyridyl)chromen-7-yl]oxypropionic acid ethyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=CC=N3)OC(C)C(=O)OCC

Isomeric SMILES

CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=CC=N3)O[C@H](C)C(=O)OCC

InChI

InChI=1S/C22H23NO5/c1-4-8-15-11-16-20(12-19(15)28-14(3)22(25)26-5-2)27-13-17(21(16)24)18-9-6-7-10-23-18/h6-7,9-14H,4-5,8H2,1-3H3/t14-/m1/s1