1-phenoxy-3-[2-[(1,2,3-trimethylpyrazol-1-ium-4-yl)amino]ethylamino]propan-2-ol

Systemtic Name: 1-phenoxy-3-[2-[(1,2,3-trimethylpyrazol-1-ium-4-yl)amino]ethylamino]propan-2-ol Openeye Name: 1-phenoxy-3-[2-[(1,2,3-trimethylpyrazol-1-ium-4-yl)amino]ethylamino]propan-2-ol CAS Name: 1-phenoxy-3-[2-[(1,2,3-trimethyl-4-pyrazol-1-iumyl)amino]ethylamino]-2-propanol IUPAC Name: 1-phenoxy-3-[2-[(1,2,3-trimethylpyrazol-1-ium-4-yl)amino]ethylamino]propan-2-ol Traditional Name: 1-phenoxy-3-[2-[(1,2,3-trimethylpyrazol-1-ium-4-yl)amino]ethylamino]propan-2-ol Formula: C17H27N4O2+ MolecularWeight: 319.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=[N+](N1C)C)NCCNCC(COC2=CC=CC=C2)O

Isomeric SMILES

CC1=C(C=[N+](N1C)C)NCCNCC(COC2=CC=CC=C2)O

InChI

InChI=1S/C17H27N4O2/c1-14-17(12-20(2)21(14)3)19-10-9-18-11-15(22)13-23-16-7-5-4-6-8-16/h4-8,12,15,18-19,22H,9-11,13H2,1-3H3/q+1