6-(2-ethyl-1,2,3,4-tetrazol-5-yl)-2-oxidanyl-xanthen-9-one

Systemtic Name: 6-(2-ethyl-1,2,3,4-tetrazol-5-yl)-2-oxidanyl-xanthen-9-one Openeye Name: 6-(2-ethyltetrazol-5-yl)-2-hydroxy-xanthen-9-one CAS Name: 6-(2-ethyl-5-tetrazolyl)-2-hydroxy-9-xanthenone IUPAC Name: 6-(2-ethyltetrazol-5-yl)-2-hydroxyxanthen-9-one Traditional Name: 6-(2-ethyltetrazol-5-yl)-2-hydroxy-xanthone Formula: C16H12N4O3 MolecularWeight: 308.29148

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Descriptors Computed from Structure

Canonical SMILES:

CCN1N=C(N=N1)C2=CC3=C(C=C2)C(=O)C4=C(O3)C=CC(=C4)O

Isomeric SMILES

CCN1N=C(N=N1)C2=CC3=C(C=C2)C(=O)C4=C(O3)C=CC(=C4)O

InChI

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