(2R)-1-(3-phenoxyphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(3-phenoxyphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-(3-phenoxyphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol CAS Name: (2R)-1-(3-phenoxyphenoxy)-3-(4-phenyl-1-piperazin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-(3-phenoxyphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-(3-phenoxyphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(COC2=CC=CC(=C2)OC3=CC=CC=C3)O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](COC2=CC=CC(=C2)OC3=CC=CC=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C25H28N2O3/c28-22(19-26-14-16-27(17-15-26)21-8-3-1-4-9-21)20-29-24-12-7-13-25(18-24)30-23-10-5-2-6-11-23/h1-13,18,22,28H,14-17,19-20H2/p+1/t22-/m1/s1