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

Systemtic Name: sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propan-2-yloxy-phenol Openeye Name: sodium 4-ethyl-2-isopropoxy-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]phenol CAS Name: sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propan-2-yloxyphenol IUPAC Name: sodium 4-ethyl-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]-2-propan-2-yloxyphenol Traditional Name: sodium 4-ethyl-2-isopropoxy-5-[6-methyl-6-(1,2,4-triaza-3-azanidacyclopenta-1,4-dien-5-yl)heptoxy]phenol Formula: C20H31N4NaO3 MolecularWeight: 398.47491

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1OCCCCCC(C)(C)C2=N[N-]N=N2)O)OC(C)C.[Na+]

Isomeric SMILES

CCC1=CC(=C(C=C1OCCCCCC(C)(C)C2=N[N-]N=N2)O)OC(C)C.[Na+]

InChI

InChI=1S/C20H31N4O3.Na/c1-6-15-12-18(27-14(2)3)16(25)13-17(15)26-11-9-7-8-10-20(4,5)19-21-23-24-22-19;/h12-14H,6-11H2,1-5H3,(H-,21,22,23,24,25);/q-1;+1