(1S,2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-phenyl-propan-1-amine

Systemtic Name: (1S,2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-phenyl-propan-1-amine Openeye Name: (1S,2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-phenyl-propan-1-amine CAS Name: (1S,2S)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-1-phenyl-1-propanamine IUPAC Name: (1S,2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-phenylpropan-1-amine Traditional Name: [(1S,2S)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-phenyl-propyl]amine Formula: C15H25N2+ MolecularWeight: 233.3724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2/c1-12-7-6-10-17(11-12)13(2)15(16)14-8-4-3-5-9-14/h3-5,8-9,12-13,15H,6-7,10-11,16H2,1-2H3/p+1/t12-,13-,15+/m0/s1