4-[4-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,4-diazepan-1-yl]aniline chloride

Systemtic Name: 4-[4-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,4-diazepan-1-yl]aniline chloride Openeye Name: 4-[4-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,4-diazepan-1-yl]aniline chloride CAS Name: 4-[4-[3-(1-methyl-1-pyrrolidin-1-iumyl)propyl]-1,4-diazepan-1-yl]aniline chloride IUPAC Name: 4-[4-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,4-diazepan-1-yl]aniline chloride Traditional Name: [4-[4-[3-(1-methylpyrrolidin-1-ium-1-yl)propyl]-1,4-diazepan-1-yl]phenyl]amine chloride Formula: C19H33ClN4 MolecularWeight: 352.94512

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1)CCCN2CCCN(CC2)C3=CC=C(C=C3)N.[Cl-]

Isomeric SMILES

C[N+]1(CCCC1)CCCN2CCCN(CC2)C3=CC=C(C=C3)N.[Cl-]

InChI

InChI=1S/C19H33N4.ClH/c1-23(15-2-3-16-23)17-5-11-21-10-4-12-22(14-13-21)19-8-6-18(20)7-9-19;/h6-9H,2-5,10-17,20H2,1H3;1H/q+1;/p-1