ethyl 2-[2-methyl-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)chromen-7-yl]oxypropanoate

Systemtic Name: ethyl 2-[2-methyl-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)chromen-7-yl]oxypropanoate Openeye Name: ethyl 2-[2-methyl-4-oxo-3-(1-phenylpyrazol-4-yl)chromen-7-yl]oxypropanoate CAS Name: 2-[[2-methyl-4-oxo-3-(1-phenyl-4-pyrazolyl)-1-benzopyran-7-yl]oxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[2-methyl-4-oxo-3-(1-phenylpyrazol-4-yl)chromen-7-yl]oxypropanoate Traditional Name: 2-[4-keto-2-methyl-3-(1-phenylpyrazol-4-yl)chromen-7-yl]oxypropionic acid ethyl ester Formula: C24H22N2O5 MolecularWeight: 418.44188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H22N2O5/c1-4-29-24(28)16(3)30-19-10-11-20-21(12-19)31-15(2)22(23(20)27)17-13-25-26(14-17)18-8-6-5-7-9-18/h5-14,16H,4H2,1-3H3