4-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]aniline

Systemtic Name: 4-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]aniline Openeye Name: 4-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)-1-piperidyl]aniline CAS Name: 4-[(2S)-2-[2-(1-piperidin-1-iumyl)ethyl]-1-piperidinyl]aniline IUPAC Name: 4-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidin-1-yl]aniline Traditional Name: [4-[(2S)-2-(2-piperidin-1-ium-1-ylethyl)piperidino]phenyl]amine Formula: C18H30N3+ MolecularWeight: 288.4509

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC2CCCCN2C3=CC=C(C=C3)N

Isomeric SMILES

C1CC[NH+](CC1)CC[C@@H]2CCCCN2C3=CC=C(C=C3)N

InChI

InChI=1S/C18H29N3/c19-16-7-9-18(10-8-16)21-14-5-2-6-17(21)11-15-20-12-3-1-4-13-20/h7-10,17H,1-6,11-15,19H2/p+1/t17-/m0/s1