2-azanyl-4-(4-dimethylaminophenyl)-5-oxidanylidene-4H-oxepino[3,2-b][1]benzofuran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(4-dimethylaminophenyl)-5-oxidanylidene-4H-oxepino[3,2-b][1]benzofuran-3-carbonitrile Openeye Name: 2-amino-4-(4-dimethylaminophenyl)-5-oxo-4H-oxepino[3,2-b]benzofuran-3-carbonitrile CAS Name: 2-amino-4-(4-dimethylaminophenyl)-5-oxo-4H-oxepino[3,2-b]benzofuran-3-carbonitrile IUPAC Name: 2-amino-4-(4-dimethylaminophenyl)-5-oxo-4H-oxepino[3,2-b][1]benzofuran-3-carbonitrile Traditional Name: 2-amino-4-(4-dimethylaminophenyl)-5-keto-4H-oxepino[3,2-b]benzofuran-3-carbonitrile Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2C(=C(OC3=C(C2=O)OC4=CC=CC=C43)N)C#N

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2C(=C(OC3=C(C2=O)OC4=CC=CC=C43)N)C#N

InChI

InChI=1S/C21H17N3O3/c1-24(2)13-9-7-12(8-10-13)17-15(11-22)21(23)27-19-14-5-3-4-6-16(14)26-20(19)18(17)25/h3-10,17H,23H2,1-2H3