[(2S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]azanium

Systemtic Name: [(2S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-pyridin-3-yl-ethyl]azanium Openeye Name: [(2S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-(3-pyridyl)ethyl]ammonium CAS Name: [(2S)-2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]ammonium IUPAC Name: [(2S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-pyridin-3-ylethyl]azanium Traditional Name: [(2S)-2-[4-(2,3-dimethylphenyl)piperazino]-2-(3-pyridyl)ethyl]ammonium Formula: C19H27N4+ MolecularWeight: 311.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(C[NH3+])C3=CN=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)[C@H](C[NH3+])C3=CN=CC=C3)C

InChI

InChI=1S/C19H26N4/c1-15-5-3-7-18(16(15)2)22-9-11-23(12-10-22)19(13-20)17-6-4-8-21-14-17/h3-8,14,19H,9-13,20H2,1-2H3/p+1/t19-/m1/s1