4-butyl-6-(1,2-dihydropyrazol-3-ylidene)-8-methyl-chromene-2,7-dione

Systemtic Name: 4-butyl-6-(1,2-dihydropyrazol-3-ylidene)-8-methyl-chromene-2,7-dione Openeye Name: 4-butyl-6-(1,2-dihydropyrazol-3-ylidene)-8-methyl-chromene-2,7-dione CAS Name: 4-butyl-6-(1,2-dihydropyrazol-3-ylidene)-8-methyl-1-benzopyran-2,7-dione IUPAC Name: 4-butyl-6-(1,2-dihydropyrazol-3-ylidene)-8-methylchromene-2,7-dione Traditional Name: 4-butyl-8-methyl-6-(3-pyrazolin-3-ylidene)chromene-2,7-quinone Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C(C(=O)C(=C3C=CNN3)C=C12)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C(C(=O)C(=C3C=CNN3)C=C12)C

InChI

InChI=1S/C17H18N2O3/c1-3-4-5-11-8-15(20)22-17-10(2)16(21)13(9-12(11)17)14-6-7-18-19-14/h6-9,18-19H,3-5H2,1-2H3