6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline

Systemtic Name: 6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Openeye Name: 6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline CAS Name: 6-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-1,2,3,4-tetrahydroquinoline IUPAC Name: 6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,2,3,4-tetrahydroquinoline Traditional Name: 6-[[(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)CC2=CC3=C(C=C2)NCCC3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=CC3=C(C=C2)NCCC3

InChI

InChI=1S/C16H24N2/c1-13-4-3-9-18(11-13)12-14-6-7-16-15(10-14)5-2-8-17-16/h6-7,10,13,17H,2-5,8-9,11-12H2,1H3/p+1/t13-/m0/s1