(1S)-1-phenyl-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamine

Systemtic Name: (1S)-1-phenyl-2-[4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamine Openeye Name: (1S)-2-(4-benzylpiperazin-1-ium-1-yl)-1-phenyl-ethanamine CAS Name: (1S)-1-phenyl-2-[4-(phenylmethyl)-1-piperazin-1-iumyl]ethanamine IUPAC Name: (1S)-2-(4-benzylpiperazin-1-ium-1-yl)-1-phenylethanamine Traditional Name: [(1S)-2-(4-benzylpiperazin-1-ium-1-yl)-1-phenyl-ethyl]amine Formula: C19H26N3+ MolecularWeight: 296.42984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(C2=CC=CC=C2)N)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](C2=CC=CC=C2)N)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3/c20-19(18-9-5-2-6-10-18)16-22-13-11-21(12-14-22)15-17-7-3-1-4-8-17/h1-10,19H,11-16,20H2/p+1/t19-/m1/s1