1-[[4-[ethyl-(phenylmethyl)amino]phenyl]methyl]piperidin-1-ium-4-amine

Systemtic Name: 1-[[4-[ethyl-(phenylmethyl)amino]phenyl]methyl]piperidin-1-ium-4-amine Openeye Name: 1-[[4-[benzyl(ethyl)amino]phenyl]methyl]piperidin-1-ium-4-amine CAS Name: 1-[[4-[ethyl-(phenylmethyl)amino]phenyl]methyl]-4-piperidin-1-iumamine IUPAC Name: 1-[[4-[benzyl(ethyl)amino]phenyl]methyl]piperidin-1-ium-4-amine Traditional Name: [4-[(4-aminopiperidin-1-ium-1-yl)methyl]phenyl]-benzyl-ethyl-amine Formula: C21H30N3+ MolecularWeight: 324.483

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C[NH+]3CCC(CC3)N

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C[NH+]3CCC(CC3)N

InChI

InChI=1S/C21H29N3/c1-2-24(17-18-6-4-3-5-7-18)21-10-8-19(9-11-21)16-23-14-12-20(22)13-15-23/h3-11,20H,2,12-17,22H2,1H3/p+1