1-(2-phenoxyethyl)-4-[[(2S)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium

Systemtic Name: 1-(2-phenoxyethyl)-4-[[(2S)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Openeye Name: 1-(2-phenoxyethyl)-4-[[(2S)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium CAS Name: 1-(2-phenoxyethyl)-4-[[(2S)-2-pyrrolidin-1-iumyl]methyl]piperazin-1-ium IUPAC Name: 1-(2-phenoxyethyl)-4-[[(2S)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Traditional Name: 1-(2-phenoxyethyl)-4-[[(2S)-pyrrolidin-1-ium-2-yl]methyl]piperazin-1-ium Formula: C17H29N3O+2 MolecularWeight: 291.43166

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)CN2CC[NH+](CC2)CCOC3=CC=CC=C3

Isomeric SMILES

C1C[C@H]([NH2+]C1)CN2CC[NH+](CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C17H27N3O/c1-2-6-17(7-3-1)21-14-13-19-9-11-20(12-10-19)15-16-5-4-8-18-16/h1-3,6-7,16,18H,4-5,8-15H2/p+2/t16-/m0/s1