[8-acetyloxy-2-methyl-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)chromen-7-yl] ethanoate

Systemtic Name: [8-acetyloxy-2-methyl-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)chromen-7-yl] ethanoate Openeye Name: [8-acetoxy-2-methyl-4-oxo-3-(1-phenylpyrazol-4-yl)chromen-7-yl] acetate CAS Name: acetic acid [8-acetyloxy-2-methyl-4-oxo-3-(1-phenyl-4-pyrazolyl)-1-benzopyran-7-yl] ester IUPAC Name: [8-acetyloxy-2-methyl-4-oxo-3-(1-phenylpyrazol-4-yl)chromen-7-yl] acetate Traditional Name: acetic acid [8-acetoxy-4-keto-2-methyl-3-(1-phenylpyrazol-4-yl)chromen-7-yl] ester Formula: C23H18N2O6 MolecularWeight: 418.39882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)OC(=O)C)OC(=O)C)C3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)OC(=O)C)OC(=O)C)C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H18N2O6/c1-13-20(16-11-24-25(12-16)17-7-5-4-6-8-17)21(28)18-9-10-19(30-14(2)26)23(22(18)29-13)31-15(3)27/h4-12H,1-3H3