N-[[4-[4-(3-cyanopyrrol-1-yl)phenyl]-5-oxidanylidene-1,2-oxazol-2-yl]methyl]ethanamide

Systemtic Name: N-[[4-[4-(3-cyanopyrrol-1-yl)phenyl]-5-oxidanylidene-1,2-oxazol-2-yl]methyl]ethanamide Openeye Name: N-[[4-[4-(3-cyanopyrrol-1-yl)phenyl]-5-oxo-isoxazol-2-yl]methyl]acetamide CAS Name: N-[[4-[4-(3-cyano-1-pyrrolyl)phenyl]-5-oxo-2-isoxazolyl]methyl]acetamide IUPAC Name: N-[[4-[4-(3-cyanopyrrol-1-yl)phenyl]-5-oxo-1,2-oxazol-2-yl]methyl]acetamide Traditional Name: N-[[4-[4-(3-cyanopyrrol-1-yl)phenyl]-5-keto-3-isoxazolin-2-yl]methyl]acetamide Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCN1C=C(C(=O)O1)C2=CC=C(C=C2)N3C=CC(=C3)C#N

Isomeric SMILES

CC(=O)NCN1C=C(C(=O)O1)C2=CC=C(C=C2)N3C=CC(=C3)C#N

InChI

InChI=1S/C17H14N4O3/c1-12(22)19-11-21-10-16(17(23)24-21)14-2-4-15(5-3-14)20-7-6-13(8-18)9-20/h2-7,9-10H,11H2,1H3,(H,19,22)