(2S)-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline

Systemtic Name: (2S)-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Openeye Name: (2S)-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline CAS Name: (2S)-2-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-1,2,3,4-tetrahydroquinoline IUPAC Name: (2S)-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Traditional Name: (2S)-2-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Formula: C16H25N2+ MolecularWeight: 245.3831

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2CCC3=CC=CC=C3N2

Isomeric SMILES

C[C@H]1CCC[NH+](C1)C[C@@H]2CCC3=CC=CC=C3N2

InChI

InChI=1S/C16H24N2/c1-13-5-4-10-18(11-13)12-15-9-8-14-6-2-3-7-16(14)17-15/h2-3,6-7,13,15,17H,4-5,8-12H2,1H3/p+1/t13-,15-/m0/s1