6-nitro-4-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-nitro-4-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-nitro-4-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1,4-benzoxazin-3-one CAS Name: 6-nitro-4-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-nitro-4-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-1,4-benzoxazin-3-one Traditional Name: 4-[2-keto-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-6-nitro-1,4-benzoxazin-3-one Formula: C23H19N3O5S MolecularWeight: 449.47906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C2=C1SC=C2)C3=CC=CC=C3)C(=O)CN4C(=O)COC5=C4C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(C(C2=C1SC=C2)C3=CC=CC=C3)C(=O)CN4C(=O)COC5=C4C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O5S/c27-21(13-25-18-12-16(26(29)30)6-7-19(18)31-14-22(25)28)24-10-8-20-17(9-11-32-20)23(24)15-4-2-1-3-5-15/h1-7,9,11-12,23H,8,10,13-14H2