2-azanyl-6-ethoxy-7-methyl-4-(4-nitrophenyl)-5-oxidanylidene-4H-oxepine-3-carbonitrile

Systemtic Name: 2-azanyl-6-ethoxy-7-methyl-4-(4-nitrophenyl)-5-oxidanylidene-4H-oxepine-3-carbonitrile Openeye Name: 2-amino-6-ethoxy-7-methyl-4-(4-nitrophenyl)-5-oxo-4H-oxepine-3-carbonitrile CAS Name: 2-amino-6-ethoxy-7-methyl-4-(4-nitrophenyl)-5-oxo-4H-oxepin-3-carbonitrile IUPAC Name: 2-amino-6-ethoxy-7-methyl-4-(4-nitrophenyl)-5-oxo-4H-oxepine-3-carbonitrile Traditional Name: 2-amino-6-ethoxy-5-keto-7-methyl-4-(4-nitrophenyl)-4H-oxepin-3-carbonitrile Formula: C16H15N3O5 MolecularWeight: 329.3074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(OC(=C(C(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C#N)N)C

Isomeric SMILES

CCOC1=C(OC(=C(C(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C#N)N)C

InChI

InChI=1S/C16H15N3O5/c1-3-23-15-9(2)24-16(18)12(8-17)13(14(15)20)10-4-6-11(7-5-10)19(21)22/h4-7,13H,3,18H2,1-2H3