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

Systemtic Name: (4E)-4-[(1-methylpyrrol-2-yl)methylidene]-3-propan-2-yloxy-1H-pyrazol-5-one Openeye Name: (4E)-3-isopropoxy-4-[(1-methylpyrrol-2-yl)methylene]-1H-pyrazol-5-one CAS Name: (4E)-4-[(1-methyl-2-pyrrolyl)methylidene]-3-propan-2-yloxy-1H-pyrazol-5-one IUPAC Name: (4E)-4-[(1-methylpyrrol-2-yl)methylidene]-3-propan-2-yloxy-1H-pyrazol-5-one Traditional Name: (4E)-5-isopropoxy-4-[(1-methylpyrrol-2-yl)methylene]-2-pyrazolin-3-one Formula: C12H15N3O2 MolecularWeight: 233.2664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NNC(=O)C1=CC2=CC=CN2C

Isomeric SMILES

CC(C)OC\1=NNC(=O)/C1=C/C2=CC=CN2C

InChI

InChI=1S/C12H15N3O2/c1-8(2)17-12-10(11(16)13-14-12)7-9-5-4-6-15(9)3/h4-8H,1-3H3,(H,13,16)/b10-7-