4-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]aniline

Systemtic Name: 4-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]aniline Openeye Name: 4-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]aniline CAS Name: 4-[3-[(3S)-3-methyl-1-piperidin-1-iumyl]propyl]aniline IUPAC Name: 4-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]aniline Traditional Name: [4-[3-[(3S)-3-methylpiperidin-1-ium-1-yl]propyl]phenyl]amine Formula: C15H25N2+ MolecularWeight: 233.3724

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCC2=CC=C(C=C2)N

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCC2=CC=C(C=C2)N

InChI

InChI=1S/C15H24N2/c1-13-4-2-10-17(12-13)11-3-5-14-6-8-15(16)9-7-14/h6-9,13H,2-5,10-12,16H2,1H3/p+1/t13-/m0/s1