4-[3-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrrolidin-1-yl]aniline chloride

Systemtic Name: 4-[3-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrrolidin-1-yl]aniline chloride Openeye Name: 4-[3-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrrolidin-1-yl]aniline chloride CAS Name: 4-[3-[2-(1-methyl-1-piperidin-1-iumyl)ethoxy]-1-pyrrolidinyl]aniline chloride IUPAC Name: 4-[3-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrrolidin-1-yl]aniline chloride Traditional Name: [4-[3-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]pyrrolidino]phenyl]amine chloride Formula: C18H30ClN3O MolecularWeight: 339.9033

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCOC2CCN(C2)C3=CC=C(C=C3)N.[Cl-]

Isomeric SMILES

C[N+]1(CCCCC1)CCOC2CCN(C2)C3=CC=C(C=C3)N.[Cl-]

InChI

InChI=1S/C18H30N3O.ClH/c1-21(11-3-2-4-12-21)13-14-22-18-9-10-20(15-18)17-7-5-16(19)6-8-17;/h5-8,18H,2-4,9-15,19H2,1H3;1H/q+1;/p-1