(3E)-3-[(3-butoxy-4-methoxy-phenyl)methylidene]-9-oxidanylidene-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate

Systemtic Name: (3E)-3-[(3-butoxy-4-methoxy-phenyl)methylidene]-9-oxidanylidene-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate Openeye Name: (3E)-3-[(3-butoxy-4-methoxy-phenyl)methylene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate CAS Name: (3E)-3-[(3-butoxy-4-methoxyphenyl)methylidene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate IUPAC Name: (3E)-3-[(3-butoxy-4-methoxyphenyl)methylidene]-9-oxo-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate Traditional Name: (3E)-3-(3-butoxy-4-methoxy-benzylidene)-9-keto-1,2-dihydropyrrolo[2,1-b]quinazoline-6-carboxylate Formula: C24H23N2O5- MolecularWeight: 419.44982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=C2CCN3C2=NC4=C(C3=O)C=CC(=C4)C(=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)/C=C/2\CCN3C2=NC4=C(C3=O)C=CC(=C4)C(=O)[O-])OC

InChI

InChI=1S/C24H24N2O5/c1-3-4-11-31-21-13-15(5-8-20(21)30-2)12-16-9-10-26-22(16)25-19-14-17(24(28)29)6-7-18(19)23(26)27/h5-8,12-14H,3-4,9-11H2,1-2H3,(H,28,29)/p-1/b16-12+