2-[(4-butoxyphenyl)methyl]-3-methyl-1H-pyrazol-5-one

Systemtic Name: 2-[(4-butoxyphenyl)methyl]-3-methyl-1H-pyrazol-5-one Openeye Name: 2-[(4-butoxyphenyl)methyl]-3-methyl-1H-pyrazol-5-one CAS Name: 2-[(4-butoxyphenyl)methyl]-3-methyl-1H-pyrazol-5-one IUPAC Name: 2-[(4-butoxyphenyl)methyl]-3-methyl-1H-pyrazol-5-one Traditional Name: 1-(4-butoxybenzyl)-5-methyl-3-pyrazolin-3-one Formula: C15H20N2O2 MolecularWeight: 260.3315

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN2C(=CC(=O)N2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN2C(=CC(=O)N2)C

InChI

InChI=1S/C15H20N2O2/c1-3-4-9-19-14-7-5-13(6-8-14)11-17-12(2)10-15(18)16-17/h5-8,10H,3-4,9,11H2,1-2H3,(H,16,18)