(2R)-N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-tert-butyl-2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-tert-butyl-2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]propionamide Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)[NH+]1CCN(CC1)C2=CC=C(C=C2)O

Isomeric SMILES

C[C@H](C(=O)NC(C)(C)C)[NH+]1CCN(CC1)C2=CC=C(C=C2)O

InChI

InChI=1S/C17H27N3O2/c1-13(16(22)18-17(2,3)4)19-9-11-20(12-10-19)14-5-7-15(21)8-6-14/h5-8,13,21H,9-12H2,1-4H3,(H,18,22)/p+1/t13-/m1/s1