N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1,3-benzoxazol-2-amine

Systemtic Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1,3-benzoxazol-2-amine Openeye Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1,3-benzoxazol-2-amine CAS Name: N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-1,3-benzoxazol-2-amine IUPAC Name: N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1,3-benzoxazol-2-amine Traditional Name: 1,3-benzoxazol-2-yl-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]amine Formula: C16H24N3O+ MolecularWeight: 274.38126

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC2=NC3=CC=CC=C3O2

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C16H23N3O/c1-13-7-4-5-11-19(13)12-6-10-17-16-18-14-8-2-3-9-15(14)20-16/h2-3,8-9,13H,4-7,10-12H2,1H3,(H,17,18)/p+1/t13-/m0/s1