1-[1-methyl-5-[(1E,3E)-4-(oxidanylamino)buta-1,3-dienyl]pyrrol-3-yl]-2-phenyl-ethanone

Systemtic Name: 1-[1-methyl-5-[(1E,3E)-4-(oxidanylamino)buta-1,3-dienyl]pyrrol-3-yl]-2-phenyl-ethanone Openeye Name: 1-[5-[(1E,3E)-4-(hydroxyamino)buta-1,3-dienyl]-1-methyl-pyrrol-3-yl]-2-phenyl-ethanone CAS Name: 1-[5-[(1E,3E)-4-(hydroxyamino)buta-1,3-dienyl]-1-methyl-3-pyrrolyl]-2-phenylethanone IUPAC Name: 1-[5-[(1E,3E)-4-(hydroxyamino)buta-1,3-dienyl]-1-methylpyrrol-3-yl]-2-phenylethanone Traditional Name: 1-[5-[(1E,3E)-4-(hydroxyamino)buta-1,3-dienyl]-1-methyl-pyrrol-3-yl]-2-phenyl-ethanone Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C=CC=CNO)C(=O)CC2=CC=CC=C2

Isomeric SMILES

CN1C=C(C=C1/C=C/C=C/NO)C(=O)CC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O2/c1-19-13-15(12-16(19)9-5-6-10-18-21)17(20)11-14-7-3-2-4-8-14/h2-10,12-13,18,21H,11H2,1H3/b9-5+,10-6+