sodium 8-butoxy-3-(2H-1,2,3,4-tetrazol-5-yl)chromen-2-one

Systemtic Name: sodium 8-butoxy-3-(2H-1,2,3,4-tetrazol-5-yl)chromen-2-one Openeye Name: sodium 8-butoxy-3-(2H-tetrazol-5-yl)chromen-2-one CAS Name: sodium 8-butoxy-3-(2H-tetrazol-5-yl)-1-benzopyran-2-one IUPAC Name: sodium 8-butoxy-3-(2H-tetrazol-5-yl)chromen-2-one Traditional Name: sodium 8-butoxy-3-(2H-tetrazol-5-yl)coumarin Formula: C14H14N4NaO3+ MolecularWeight: 309.27573

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NNN=N3.[Na+]

Isomeric SMILES

CCCCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NNN=N3.[Na+]

InChI

InChI=1S/C14H14N4O3.Na/c1-2-3-7-20-11-6-4-5-9-8-10(13-15-17-18-16-13)14(19)21-12(9)11;/h4-6,8H,2-3,7H2,1H3,(H,15,16,17,18);/q;+1