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

Systemtic Name: (2R)-1-(4-morpholin-4-ylsulfonylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Openeye Name: (2R)-1-(4-morpholinosulfonylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol CAS Name: (2R)-1-[4-(4-morpholinylsulfonyl)phenoxy]-3-(4-phenyl-1-piperazin-1-iumyl)-2-propanol IUPAC Name: (2R)-1-(4-morpholin-4-ylsulfonylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Traditional Name: (2R)-1-(4-morpholinosulfonylphenoxy)-3-(4-phenylpiperazin-1-ium-1-yl)propan-2-ol Formula: C23H32N3O5S+ MolecularWeight: 462.58228

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(COC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](COC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)O)C4=CC=CC=C4

InChI

InChI=1S/C23H31N3O5S/c27-21(18-24-10-12-25(13-11-24)20-4-2-1-3-5-20)19-31-22-6-8-23(9-7-22)32(28,29)26-14-16-30-17-15-26/h1-9,21,27H,10-19H2/p+1/t21-/m1/s1