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

Systemtic Name: ethyl 7-methoxy-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)oxy-chromene-2-carboxylate Openeye Name: ethyl 7-methoxy-4-oxo-3-(1-phenylpyrazol-4-yl)oxy-chromene-2-carboxylate CAS Name: 7-methoxy-4-oxo-3-[(1-phenyl-4-pyrazolyl)oxy]-1-benzopyran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-methoxy-4-oxo-3-(1-phenylpyrazol-4-yl)oxychromene-2-carboxylate Traditional Name: 4-keto-7-methoxy-3-(1-phenylpyrazol-4-yl)oxy-chromene-2-carboxylic acid ethyl ester Formula: C22H18N2O6 MolecularWeight: 406.38812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC)OC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC)OC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O6/c1-3-28-22(26)21-20(19(25)17-10-9-15(27-2)11-18(17)30-21)29-16-12-23-24(13-16)14-7-5-4-6-8-14/h4-13H,3H2,1-2H3