N-[(E)-1-(1-benzofuran-2-yl)ethylideneamino]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-1-(1-benzofuran-2-yl)ethylideneamino]-3-ethyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(E)-1-(benzofuran-2-yl)ethylideneamino]-3-ethyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-1-(2-benzofuranyl)ethylideneamino]-3-ethyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(E)-1-(1-benzofuran-2-yl)ethylideneamino]-3-ethyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(E)-1-(benzofuran-2-yl)ethylideneamino]-3-ethyl-4-keto-phthalazine-1-carboxamide Formula: C21H18N4O3 MolecularWeight: 374.39262

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN=C(C)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N/N=C(\C)/C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H18N4O3/c1-3-25-21(27)16-10-6-5-9-15(16)19(24-25)20(26)23-22-13(2)18-12-14-8-4-7-11-17(14)28-18/h4-12H,3H2,1-2H3,(H,23,26)/b22-13+