2-[2-heptyl-4,5-bis(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrazolidin-2-ium-1-yl]-1,3-oxazole

Systemtic Name: 2-[2-heptyl-4,5-bis(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrazolidin-2-ium-1-yl]-1,3-oxazole Openeye Name: 2-[2-heptyl-4,5-bis(4-methoxyphenyl)-2-methyl-tetrazolidin-2-ium-1-yl]oxazole CAS Name: 2-[2-heptyl-4,5-bis(4-methoxyphenyl)-2-methyl-1-tetrazolidin-2-iumyl]oxazole IUPAC Name: 2-[2-heptyl-4,5-bis(4-methoxyphenyl)-2-methyltetrazolidin-2-ium-1-yl]-1,3-oxazole Traditional Name: 2-[2-heptyl-4,5-bis(4-methoxyphenyl)-2-methyl-tetrazolidin-2-ium-1-yl]oxazole Formula: C26H36N5O3+ MolecularWeight: 466.59574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1(NN(C(N1C2=NC=CO2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CCCCCCC[N+]1(NN(C(N1C2=NC=CO2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C26H36N5O3/c1-5-6-7-8-9-19-31(2)28-29(22-12-16-24(33-4)17-13-22)25(30(31)26-27-18-20-34-26)21-10-14-23(32-3)15-11-21/h10-18,20,25,28H,5-9,19H2,1-4H3/q+1