ethyl 7-ethoxy-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylate

Systemtic Name: ethyl 7-ethoxy-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylate Openeye Name: ethyl 7-ethoxy-4-oxo-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylate CAS Name: 7-ethoxy-4-oxo-3-(1-phenyl-4-pyrazolyl)-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-ethoxy-4-oxo-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylate Traditional Name: 7-ethoxy-4-keto-3-(1-phenylpyrazol-4-yl)chromene-2-carboxylic acid ethyl ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(=O)OCC)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(=O)C(=C(O2)C(=O)OCC)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H20N2O5/c1-3-28-17-10-11-18-19(12-17)30-22(23(27)29-4-2)20(21(18)26)15-13-24-25(14-15)16-8-6-5-7-9-16/h5-14H,3-4H2,1-2H3