N,N-dimethyl-4-[3-[(5E)-5-[(1-methylimidazol-2-yl)methylidene]-1-oxidanyl-4-oxidanylidene-cyclopent-2-en-1-yl]prop-1-ynyl]benzamide

Systemtic Name: N,N-dimethyl-4-[3-[(5E)-5-[(1-methylimidazol-2-yl)methylidene]-1-oxidanyl-4-oxidanylidene-cyclopent-2-en-1-yl]prop-1-ynyl]benzamide Openeye Name: 4-[3-[(5E)-1-hydroxy-5-[(1-methylimidazol-2-yl)methylene]-4-oxo-cyclopent-2-en-1-yl]prop-1-ynyl]-N,N-dimethyl-benzamide CAS Name: 4-[3-[(5E)-1-hydroxy-5-[(1-methyl-2-imidazolyl)methylidene]-4-oxo-1-cyclopent-2-enyl]prop-1-ynyl]-N,N-dimethylbenzamide IUPAC Name: 4-[3-[(5E)-1-hydroxy-5-[(1-methylimidazol-2-yl)methylidene]-4-oxocyclopent-2-en-1-yl]prop-1-ynyl]-N,N-dimethylbenzamide Traditional Name: 4-[3-[(5E)-1-hydroxy-4-keto-5-[(1-methylimidazol-2-yl)methylene]cyclopent-2-en-1-yl]prop-1-ynyl]-N,N-dimethyl-benzamide Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C=C2C(=O)C=CC2(CC#CC3=CC=C(C=C3)C(=O)N(C)C)O

Isomeric SMILES

CN1C=CN=C1/C=C\2/C(=O)C=CC2(CC#CC3=CC=C(C=C3)C(=O)N(C)C)O

InChI

InChI=1S/C22H21N3O3/c1-24(2)21(27)17-8-6-16(7-9-17)5-4-11-22(28)12-10-19(26)18(22)15-20-23-13-14-25(20)3/h6-10,12-15,28H,11H2,1-3H3/b18-15-