4-[(1S)-1-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethyl]aniline

Systemtic Name: 4-[(1S)-1-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethyl]aniline Openeye Name: 4-[(1S)-1-(4-benzylpiperidin-1-ium-1-yl)ethyl]aniline CAS Name: 4-[(1S)-1-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethyl]aniline IUPAC Name: 4-[(1S)-1-(4-benzylpiperidin-1-ium-1-yl)ethyl]aniline Traditional Name: [4-[(1S)-1-(4-benzylpiperidin-1-ium-1-yl)ethyl]phenyl]amine Formula: C20H27N2+ MolecularWeight: 295.44178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N)[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N)[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2/c1-16(19-7-9-20(21)10-8-19)22-13-11-18(12-14-22)15-17-5-3-2-4-6-17/h2-10,16,18H,11-15,21H2,1H3/p+1/t16-/m0/s1