(4Z)-2-(4-butoxyphenyl)-4-[(1-methylpyrazol-4-yl)methylidene]-1,3-oxazol-5-one

Systemtic Name: (4Z)-2-(4-butoxyphenyl)-4-[(1-methylpyrazol-4-yl)methylidene]-1,3-oxazol-5-one Openeye Name: (4Z)-2-(4-butoxyphenyl)-4-[(1-methylpyrazol-4-yl)methylene]oxazol-5-one CAS Name: (4Z)-2-(4-butoxyphenyl)-4-[(1-methyl-4-pyrazolyl)methylidene]-5-oxazolone IUPAC Name: (4Z)-2-(4-butoxyphenyl)-4-[(1-methylpyrazol-4-yl)methylidene]-1,3-oxazol-5-one Traditional Name: (4Z)-2-(4-butoxyphenyl)-4-[(1-methylpyrazol-4-yl)methylene]-2-oxazolin-5-one Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC(=CC3=CN(N=C3)C)C(=O)O2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=N/C(=C\C3=CN(N=C3)C)/C(=O)O2

InChI

InChI=1S/C18H19N3O3/c1-3-4-9-23-15-7-5-14(6-8-15)17-20-16(18(22)24-17)10-13-11-19-21(2)12-13/h5-8,10-12H,3-4,9H2,1-2H3/b16-10-