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

Systemtic Name: [(1S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-phenyl-ethyl]azanium Openeye Name: [(1S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-phenyl-ethyl]ammonium CAS Name: [(1S)-2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-1-phenylethyl]ammonium IUPAC Name: [(1S)-2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-phenylethyl]azanium Traditional Name: [(1S)-2-[4-(2,3-dimethylphenyl)piperazino]-1-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)CC(C3=CC=CC=C3)[NH3+])C

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3/c1-16-7-6-10-20(17(16)2)23-13-11-22(12-14-23)15-19(21)18-8-4-3-5-9-18/h3-10,19H,11-15,21H2,1-2H3/p+1/t19-/m1/s1