2-[2-[1-(phenylmethyl)piperidin-1-ium-1-yl]propyl]aniline

Systemtic Name: 2-[2-[1-(phenylmethyl)piperidin-1-ium-1-yl]propyl]aniline Openeye Name: 2-[2-(1-benzylpiperidin-1-ium-1-yl)propyl]aniline CAS Name: 2-[2-[1-(phenylmethyl)-1-piperidin-1-iumyl]propyl]aniline IUPAC Name: 2-[2-(1-benzylpiperidin-1-ium-1-yl)propyl]aniline Traditional Name: [2-[2-(1-benzylpiperidin-1-ium-1-yl)propyl]phenyl]amine Formula: C21H29N2+ MolecularWeight: 309.46836

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1N)[N+]2(CCCCC2)CC3=CC=CC=C3

Isomeric SMILES

CC(CC1=CC=CC=C1N)[N+]2(CCCCC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H29N2/c1-18(16-20-12-6-7-13-21(20)22)23(14-8-3-9-15-23)17-19-10-4-2-5-11-19/h2,4-7,10-13,18H,3,8-9,14-17,22H2,1H3/q+1