4-[(2S)-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]piperidin-1-yl]aniline

Systemtic Name: 4-[(2S)-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]piperidin-1-yl]aniline Openeye Name: 4-[(2S)-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]-1-piperidyl]aniline CAS Name: 4-[(2S)-2-[2-[(3S)-3-methyl-1-piperidin-1-iumyl]ethyl]-1-piperidinyl]aniline IUPAC Name: 4-[(2S)-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]piperidin-1-yl]aniline Traditional Name: [4-[(2S)-2-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethyl]piperidino]phenyl]amine Formula: C19H32N3+ MolecularWeight: 302.47748

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCC2CCCCN2C3=CC=C(C=C3)N

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC[C@@H]2CCCCN2C3=CC=C(C=C3)N

InChI

InChI=1S/C19H31N3/c1-16-5-4-12-21(15-16)14-11-18-6-2-3-13-22(18)19-9-7-17(20)8-10-19/h7-10,16,18H,2-6,11-15,20H2,1H3/p+1/t16-,18-/m0/s1