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

Systemtic Name: [(2S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-phenyl-ethyl]azanium Openeye Name: [(2S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-phenyl-ethyl]ammonium CAS Name: [(2S)-2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-phenylethyl]ammonium IUPAC Name: [(2S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-phenylethyl]azanium Traditional Name: [(2S)-2-[4-(2,3-dimethylphenyl)piperazino]-2-phenyl-ethyl]ammonium Formula: C20H28N3+ MolecularWeight: 310.45642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3/c1-16-7-6-10-19(17(16)2)22-11-13-23(14-12-22)20(15-21)18-8-4-3-5-9-18/h3-10,20H,11-15,21H2,1-2H3/p+1/t20-/m1/s1