6,7-dimethoxy-2-[2-(5-nitrothiophen-2-yl)ethenyl]-3,1-benzoxazin-4-one

Systemtic Name: 6,7-dimethoxy-2-[2-(5-nitrothiophen-2-yl)ethenyl]-3,1-benzoxazin-4-one Openeye Name: 6,7-dimethoxy-2-[2-(5-nitro-2-thienyl)vinyl]-3,1-benzoxazin-4-one CAS Name: 6,7-dimethoxy-2-[2-(5-nitro-2-thiophenyl)ethenyl]-3,1-benzoxazin-4-one IUPAC Name: 6,7-dimethoxy-2-[2-(5-nitrothiophen-2-yl)ethenyl]-3,1-benzoxazin-4-one Traditional Name: 6,7-dimethoxy-2-[2-(5-nitro-2-thienyl)vinyl]-3,1-benzoxazin-4-one Formula: C16H12N2O6S MolecularWeight: 360.34128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)OC(=N2)C=CC3=CC=C(S3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)OC(=N2)C=CC3=CC=C(S3)[N+](=O)[O-])OC

InChI

InChI=1S/C16H12N2O6S/c1-22-12-7-10-11(8-13(12)23-2)17-14(24-16(10)19)5-3-9-4-6-15(25-9)18(20)21/h3-8H,1-2H3