2-azanyl-6-ethoxy-5-oxidanylidene-4,7-diphenyl-4H-oxepine-3-carbonitrile

Systemtic Name: 2-azanyl-6-ethoxy-5-oxidanylidene-4,7-diphenyl-4H-oxepine-3-carbonitrile Openeye Name: 2-amino-6-ethoxy-5-oxo-4,7-diphenyl-4H-oxepine-3-carbonitrile CAS Name: 2-amino-6-ethoxy-5-oxo-4,7-diphenyl-4H-oxepin-3-carbonitrile IUPAC Name: 2-amino-6-ethoxy-5-oxo-4,7-diphenyl-4H-oxepine-3-carbonitrile Traditional Name: 2-amino-6-ethoxy-5-keto-4,7-diphenyl-4H-oxepin-3-carbonitrile Formula: C21H18N2O3 MolecularWeight: 346.37922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(OC(=C(C(C1=O)C2=CC=CC=C2)C#N)N)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(OC(=C(C(C1=O)C2=CC=CC=C2)C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C21H18N2O3/c1-2-25-20-18(24)17(14-9-5-3-6-10-14)16(13-22)21(23)26-19(20)15-11-7-4-8-12-15/h3-12,17H,2,23H2,1H3