1,8-diethoxy-3-(2H-1,2,3,4-tetrazol-5-yl)anthracene-9,10-dione

Systemtic Name: 1,8-diethoxy-3-(2H-1,2,3,4-tetrazol-5-yl)anthracene-9,10-dione Openeye Name: 1,8-diethoxy-3-(2H-tetrazol-5-yl)anthracene-9,10-dione CAS Name: 1,8-diethoxy-3-(2H-tetrazol-5-yl)anthracene-9,10-dione IUPAC Name: 1,8-diethoxy-3-(2H-tetrazol-5-yl)anthracene-9,10-dione Traditional Name: 1,8-diethoxy-3-(2H-tetrazol-5-yl)-9,10-anthraquinone Formula: C19H16N4O4 MolecularWeight: 364.35474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1C(=O)C3=C(C2=O)C=C(C=C3OCC)C4=NNN=N4

Isomeric SMILES

CCOC1=CC=CC2=C1C(=O)C3=C(C2=O)C=C(C=C3OCC)C4=NNN=N4

InChI

InChI=1S/C19H16N4O4/c1-3-26-13-7-5-6-11-15(13)18(25)16-12(17(11)24)8-10(9-14(16)27-4-2)19-20-22-23-21-19/h5-9H,3-4H2,1-2H3,(H,20,21,22,23)