4-[(3S)-3,4,4-trimethylpiperazine-1,4-diium-1-yl]aniline

Systemtic Name: 4-[(3S)-3,4,4-trimethylpiperazine-1,4-diium-1-yl]aniline Openeye Name: 4-[(3S)-3,4,4-trimethylpiperazine-1,4-diium-1-yl]aniline CAS Name: 4-[(3S)-3,4,4-trimethyl-1-piperazine-1,4-diiumyl]aniline IUPAC Name: 4-[(3S)-3,4,4-trimethylpiperazine-1,4-diium-1-yl]aniline Traditional Name: [4-[(3S)-3,4,4-trimethylpiperazine-1,4-diium-1-yl]phenyl]amine Formula: C13H23N3+2 MolecularWeight: 221.34182

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC[N+]1(C)C)C2=CC=C(C=C2)N

Isomeric SMILES

C[C@H]1C[NH+](CC[N+]1(C)C)C2=CC=C(C=C2)N

InChI

InChI=1S/C13H22N3/c1-11-10-15(8-9-16(11,2)3)13-6-4-12(14)5-7-13/h4-7,11H,8-10,14H2,1-3H3/q+1/p+1/t11-/m0/s1