(3E)-9-oxidanylidene-3-[(3-phenoxyphenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate

Systemtic Name: (3E)-9-oxidanylidene-3-[(3-phenoxyphenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate Openeye Name: (3E)-9-oxo-3-[(3-phenoxyphenyl)methylene]-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate CAS Name: (3E)-9-oxo-3-[(3-phenoxyphenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate IUPAC Name: (3E)-9-oxo-3-[(3-phenoxyphenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate Traditional Name: (3E)-9-keto-3-(3-phenoxybenzylidene)-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate Formula: C25H17N2O4- MolecularWeight: 409.41348

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(=NC3=C(C2=O)C=CC(=C3)C(=O)[O-])C1=CC4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

C\1CN2C(=NC3=C(C2=O)C=CC(=C3)C(=O)[O-])/C1=C/C4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H18N2O4/c28-24-21-10-9-18(25(29)30)15-22(21)26-23-17(11-12-27(23)24)13-16-5-4-8-20(14-16)31-19-6-2-1-3-7-19/h1-10,13-15H,11-12H2,(H,29,30)/p-1/b17-13+