sodium 2-ethoxy-6-(2H-1,2,3,4-tetrazol-5-yl)xanthen-9-one

Systemtic Name: sodium 2-ethoxy-6-(2H-1,2,3,4-tetrazol-5-yl)xanthen-9-one Openeye Name: sodium 2-ethoxy-6-(2H-tetrazol-5-yl)xanthen-9-one CAS Name: sodium 2-ethoxy-6-(2H-tetrazol-5-yl)-9-xanthenone IUPAC Name: sodium 2-ethoxy-6-(2H-tetrazol-5-yl)xanthen-9-one Traditional Name: sodium 2-ethoxy-6-(2H-tetrazol-5-yl)xanthone Formula: C16H12N4NaO3+ MolecularWeight: 331.28125

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)OC3=C(C2=O)C=CC(=C3)C4=NNN=N4.[Na+]

Isomeric SMILES

CCOC1=CC2=C(C=C1)OC3=C(C2=O)C=CC(=C3)C4=NNN=N4.[Na+]

InChI

InChI=1S/C16H12N4O3.Na/c1-2-22-10-4-6-13-12(8-10)15(21)11-5-3-9(7-14(11)23-13)16-17-19-20-18-16;/h3-8H,2H2,1H3,(H,17,18,19,20);/q;+1