2-[3-(4-imidazol-1-ylphenyl)-6-oxidanylidene-4,5-dihydropyridazin-1-yl]ethyl ethanoate

Systemtic Name: 2-[3-(4-imidazol-1-ylphenyl)-6-oxidanylidene-4,5-dihydropyridazin-1-yl]ethyl ethanoate Openeye Name: 2-[3-(4-imidazol-1-ylphenyl)-6-oxo-4,5-dihydropyridazin-1-yl]ethyl acetate CAS Name: acetic acid 2-[3-[4-(1-imidazolyl)phenyl]-6-oxo-4,5-dihydropyridazin-1-yl]ethyl ester IUPAC Name: 2-[3-(4-imidazol-1-ylphenyl)-6-oxo-4,5-dihydropyridazin-1-yl]ethyl acetate Traditional Name: acetic acid 2-[3-(4-imidazol-1-ylphenyl)-6-keto-4,5-dihydropyridazin-1-yl]ethyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1C(=O)CCC(=N1)C2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC(=O)OCCN1C(=O)CCC(=N1)C2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C17H18N4O3/c1-13(22)24-11-10-21-17(23)7-6-16(19-21)14-2-4-15(5-3-14)20-9-8-18-12-20/h2-5,8-9,12H,6-7,10-11H2,1H3