6-butyl-7-oxidanyl-3-(1H-pyrazol-5-yl)chromen-4-one

Systemtic Name: 6-butyl-7-oxidanyl-3-(1H-pyrazol-5-yl)chromen-4-one Openeye Name: 6-butyl-7-hydroxy-3-(1H-pyrazol-5-yl)chromen-4-one CAS Name: 6-butyl-7-hydroxy-3-(1H-pyrazol-5-yl)-1-benzopyran-4-one IUPAC Name: 6-butyl-7-hydroxy-3-(1H-pyrazol-5-yl)chromen-4-one Traditional Name: 6-butyl-7-hydroxy-3-(1H-pyrazol-5-yl)chromone Formula: C16H16N2O3 MolecularWeight: 284.30984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=NN3)O

Isomeric SMILES

CCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=NN3)O

InChI

InChI=1S/C16H16N2O3/c1-2-3-4-10-7-11-15(8-14(10)19)21-9-12(16(11)20)13-5-6-17-18-13/h5-9,19H,2-4H2,1H3,(H,17,18)