3-cyclopentyloxy-1-heptyl-3-(4-methoxyphenyl)-2-methyl-1-oxidanidyl-pyrazolidin-1-ium

Systemtic Name: 3-cyclopentyloxy-1-heptyl-3-(4-methoxyphenyl)-2-methyl-1-oxidanidyl-pyrazolidin-1-ium Openeye Name: 3-(cyclopentoxy)-1-heptyl-3-(4-methoxyphenyl)-2-methyl-1-oxido-pyrazolidin-1-ium CAS Name: 3-cyclopentyloxy-1-heptyl-3-(4-methoxyphenyl)-2-methyl-1-oxidopyrazolidin-1-ium IUPAC Name: 3-cyclopentyloxy-1-heptyl-3-(4-methoxyphenyl)-2-methyl-1-oxidopyrazolidin-1-ium Traditional Name: 3-(cyclopentoxy)-1-heptyl-3-(4-methoxyphenyl)-2-methyl-1-oxido-pyrazolidin-1-ium Formula: C23H38N2O3 MolecularWeight: 390.55942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1(CCC(N1C)(C2=CC=C(C=C2)OC)OC3CCCC3)[O-]

Isomeric SMILES

CCCCCCC[N+]1(CCC(N1C)(C2=CC=C(C=C2)OC)OC3CCCC3)[O-]

InChI

InChI=1S/C23H38N2O3/c1-4-5-6-7-10-18-25(26)19-17-23(24(25)2,28-22-11-8-9-12-22)20-13-15-21(27-3)16-14-20/h13-16,22H,4-12,17-19H2,1-3H3