cyclopentyl-[3-[[dimethyl(3-phenoxypropyl)azaniumyl]methyl]-1,2,4-oxadiazol-5-yl]-phenyl-methanolate

Systemtic Name: cyclopentyl-[3-[[dimethyl(3-phenoxypropyl)azaniumyl]methyl]-1,2,4-oxadiazol-5-yl]-phenyl-methanolate Openeye Name: cyclopentyl-[3-[[dimethyl(3-phenoxypropyl)ammonio]methyl]-1,2,4-oxadiazol-5-yl]-phenyl-methanolate CAS Name: cyclopentyl-[3-[[dimethyl(3-phenoxypropyl)ammonio]methyl]-1,2,4-oxadiazol-5-yl]-phenylmethanolate IUPAC Name: cyclopentyl-[3-[[dimethyl(3-phenoxypropyl)azaniumyl]methyl]-1,2,4-oxadiazol-5-yl]-phenylmethanolate Traditional Name: cyclopentyl-[3-[[dimethyl(3-phenoxypropyl)ammonio]methyl]-1,2,4-oxadiazol-5-yl]-phenyl-methanolate Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCOC1=CC=CC=C1)CC2=NOC(=N2)C(C3CCCC3)(C4=CC=CC=C4)[O-]

Isomeric SMILES

C[N+](C)(CCCOC1=CC=CC=C1)CC2=NOC(=N2)C(C3CCCC3)(C4=CC=CC=C4)[O-]

InChI

InChI=1S/C26H33N3O3/c1-29(2,18-11-19-31-23-16-7-4-8-17-23)20-24-27-25(32-28-24)26(30,22-14-9-10-15-22)21-12-5-3-6-13-21/h3-8,12-13,16-17,22H,9-11,14-15,18-20H2,1-2H3