4-[2-(pyridin-1-ium-1-ylmethyl)pyrrolidin-1-yl]aniline chloride

Systemtic Name: 4-[2-(pyridin-1-ium-1-ylmethyl)pyrrolidin-1-yl]aniline chloride Openeye Name: 4-[2-(pyridin-1-ium-1-ylmethyl)pyrrolidin-1-yl]aniline chloride CAS Name: 4-[2-(1-pyridin-1-iumylmethyl)-1-pyrrolidinyl]aniline chloride IUPAC Name: 4-[2-(pyridin-1-ium-1-ylmethyl)pyrrolidin-1-yl]aniline chloride Traditional Name: [4-[2-(pyridin-1-ium-1-ylmethyl)pyrrolidino]phenyl]amine chloride Formula: C16H20ClN3 MolecularWeight: 289.8031

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=CC=C(C=C2)N)C[N+]3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CC(N(C1)C2=CC=C(C=C2)N)C[N+]3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C16H20N3.ClH/c17-14-6-8-15(9-7-14)19-12-4-5-16(19)13-18-10-2-1-3-11-18;/h1-3,6-11,16H,4-5,12-13,17H2;1H/q+1;/p-1