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

Systemtic Name: 1,8-dimethoxy-3-(2H-1,2,3,4-tetrazol-5-yl)anthracene-9,10-dione Openeye Name: 1,8-dimethoxy-3-(2H-tetrazol-5-yl)anthracene-9,10-dione CAS Name: 1,8-dimethoxy-3-(2H-tetrazol-5-yl)anthracene-9,10-dione IUPAC Name: 1,8-dimethoxy-3-(2H-tetrazol-5-yl)anthracene-9,10-dione Traditional Name: 1,8-dimethoxy-3-(2H-tetrazol-5-yl)-9,10-anthraquinone Formula: C17H12N4O4 MolecularWeight: 336.30158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(=O)C3=C(C2=O)C=C(C=C3OC)C4=NNN=N4

Isomeric SMILES

COC1=CC=CC2=C1C(=O)C3=C(C2=O)C=C(C=C3OC)C4=NNN=N4

InChI

InChI=1S/C17H12N4O4/c1-24-11-5-3-4-9-13(11)16(23)14-10(15(9)22)6-8(7-12(14)25-2)17-18-20-21-19-17/h3-7H,1-2H3,(H,18,19,20,21)