sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propyl-phenol

Systemtic Name: sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propyl-phenol Openeye Name: sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propyl-phenol CAS Name: sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propylphenol IUPAC Name: sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propylphenol Traditional Name: sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propyl-phenol Formula: C20H31N4NaO2 MolecularWeight: 382.47551

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1O)OCCCCCC(C)(C)C2=N[N-]N=N2)CC.[Na+]

Isomeric SMILES

CCCC1=CC(=C(C=C1O)OCCCCCC(C)(C)C2=N[N-]N=N2)CC.[Na+]

InChI

InChI=1S/C20H31N4O2.Na/c1-5-10-16-13-15(6-2)18(14-17(16)25)26-12-9-7-8-11-20(3,4)19-21-23-24-22-19;/h13-14H,5-12H2,1-4H3,(H-,21,22,23,24,25);/q-1;+1