(4E)-4-[[1-(4-oxidanylbutyl)pyrrol-2-yl]methylidene]-3-propan-2-yloxy-1H-pyrazol-5-one

Systemtic Name: (4E)-4-[[1-(4-oxidanylbutyl)pyrrol-2-yl]methylidene]-3-propan-2-yloxy-1H-pyrazol-5-one Openeye Name: (4E)-4-[[1-(4-hydroxybutyl)pyrrol-2-yl]methylene]-3-isopropoxy-1H-pyrazol-5-one CAS Name: (4E)-4-[[1-(4-hydroxybutyl)-2-pyrrolyl]methylidene]-3-propan-2-yloxy-1H-pyrazol-5-one IUPAC Name: (4E)-4-[[1-(4-hydroxybutyl)pyrrol-2-yl]methylidene]-3-propan-2-yloxy-1H-pyrazol-5-one Traditional Name: (4E)-4-[[1-(4-hydroxybutyl)pyrrol-2-yl]methylene]-5-isopropoxy-2-pyrazolin-3-one Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NNC(=O)C1=CC2=CC=CN2CCCCO

Isomeric SMILES

CC(C)OC\1=NNC(=O)/C1=C/C2=CC=CN2CCCCO

InChI

InChI=1S/C15H21N3O3/c1-11(2)21-15-13(14(20)16-17-15)10-12-6-5-8-18(12)7-3-4-9-19/h5-6,8,10-11,19H,3-4,7,9H2,1-2H3,(H,16,20)/b13-10-