[6-butyl-3-(1-ethanoylpyrazol-3-yl)-4-oxidanylidene-chromen-7-yl] ethanoate

Systemtic Name: [6-butyl-3-(1-ethanoylpyrazol-3-yl)-4-oxidanylidene-chromen-7-yl] ethanoate Openeye Name: [3-(1-acetylpyrazol-3-yl)-6-butyl-4-oxo-chromen-7-yl] acetate CAS Name: acetic acid [3-(1-acetyl-3-pyrazolyl)-6-butyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(1-acetylpyrazol-3-yl)-6-butyl-4-oxochromen-7-yl] acetate Traditional Name: acetic acid [3-(1-acetylpyrazol-3-yl)-6-butyl-4-keto-chromen-7-yl] ester Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NN(C=C3)C(=O)C)OC(=O)C

Isomeric SMILES

CCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NN(C=C3)C(=O)C)OC(=O)C

InChI

InChI=1S/C20H20N2O5/c1-4-5-6-14-9-15-19(10-18(14)27-13(3)24)26-11-16(20(15)25)17-7-8-22(21-17)12(2)23/h7-11H,4-6H2,1-3H3