[4-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]phenyl]methylazanium

Systemtic Name: [4-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]phenyl]methylazanium Openeye Name: [4-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]phenyl]methylammonium CAS Name: [4-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]phenyl]methylammonium IUPAC Name: [4-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]phenyl]methylazanium Traditional Name: [4-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]benzyl]ammonium Formula: C18H25N3+2 MolecularWeight: 283.4112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)C3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)C3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C18H23N3/c1-20-11-12-21(17-9-7-15(13-19)8-10-17)18(14-20)16-5-3-2-4-6-16/h2-10,18H,11-14,19H2,1H3/p+2/t18-/m1/s1